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Proteasome subunit alpha type

The proteasome is a multicatalytic proteinase complex which is characterized by its ability to cleave peptides with Arg, Phe, Tyr, Leu, and Glu adjacent to the leaving group at neutral or slightly basic pH. The proteasome has an ATP-dependent proteolytic activity.

AlphaFold DB , UniProt , Accession G4LZ69, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 264 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51	Low	76.8	Confident	222 Å²	222	97.2 Å²	97.2	100%	1.094	48%	0.482	S	S	*	.				0	-15.7	0	-74.4	-175.9	-171.9	0	0	114
2	S	64.7	Low	77.8	Confident	66 Å²	66	98.8 Å²	98.8	46%	0.462	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-65.7	-38.3	-173.5	-158	0	0	0	0	115.9	K4 Y5 D6	S2-K4 PolarHBondContact O-N 3.43Å; S2-Y5 PolarHBondContact O-N 2.84Å; S2-D6 VanDerWaalsContact O-OD1 3.07Å
3	T	70.3	Confident	78.7	Confident	105 Å²	105	91.7 Å²	91.7	64%	0.644	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-61.5	-9.2	-166.4	48.8	0	0	0	0	116.6
4	K	80.9	Confident	79.6	Confident	170 Å²	170	92.9 Å²	92.9	74%	0.739	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-78.6	-35.3	175	-72	-172.8	179	-177.9	0	112.6	S2	S2-K4 PolarHBondContact O-N 3.43Å
5	Y	82.9	Confident	80.4	Confident	87 Å²	87	93.7 Å²	93.7	34%	0.341	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-80.8	-27.8	-175.9	-61.2	-76.8	0	0	0	111.9	S2 R7 I11 F12 P14	S2-Y5 PolarHBondContact O-N 2.84Å; Y5-R7 PolarHBondContact O-N 3.5Å; Y5-R7 VanDerWaalsContact O-N 3.16Å; Y5-I11 HydrophobicContact CD1-CG2 3.7Å; Y5-I11 HydrophobicContact CG-CG2 4.48Å; Y5-F12 WeakPolarHBondContact CD1-O 3.45Å; Y5-P14 HydrophobicContact CE1-CG 4.37Å; Y5-P14 HydrophobicContact CE2-CG 3.92Å
6	D	82.2	Confident	81.1	Confident	27 Å²	27	90.8 Å²	90.8	14%	0.144	48%	0.476	C	S	.	.	G	3₁₀ helix	trans	-71.5	-10.6	-176.2	-45.6	0.2	0	0	0	113.4	S2 F19 Q20 Y23	S2-D6 VanDerWaalsContact O-OD1 3.07Å; D6-F19 HydrophobicContact CB-CB 4.49Å; D6-F19 HydrophobicContact CB-CD2 4.48Å; D6-F19 WeakPolarHBondContact OD1-CD2 3.48Å; D6-F19 WeakPolarHBondContact OD1-CE2 3.42Å; D6-Q20 PolarHBondContact O-NE2 3.36Å; D6-Y23 HydrophobicContact CB-CE2 4.14Å; D6-Y23 PolarHBondContact OD2-OH 3.39Å
7	R	80.5	Confident	81.6	Confident	216 Å²	216	90.4 Å²	90.4	82%	0.815	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-76.4	-31.9	-168.4	-73	-171.8	174.8	-163.9	-3	114.9	Y5	Y5-R7 PolarHBondContact O-N 3.5Å; Y5-R7 VanDerWaalsContact O-N 3.16Å
8	A	79.7	Confident	82.2	Confident	33 Å²	33	86.9 Å²	86.9	27%	0.273	45%	0.452	S	S	.	.			trans	-133.5	144.1	-175.2	0	0	0	0	0	110.7	T10 I11	A8-T10 PolarHBondContact O-N 3.34Å; A8-I11 HydrophobicContact CB-CD1 3.76Å; A8-I11 HydrophobicContact CB-CG1 3.94Å; A8-I11 PolarHBondContact O-N 3.28Å
9	I	82.8	Confident	82.8	Confident	15 Å²	15	83.8 Å²	83.8	8%	0.077	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-16.9	-178.5	65.9	166.3	0	0	0	113.1	L18 Q20 Y120 T121 S123 R126 P128	I9-L18 VanDerWaalsContact O-CD2 3.23Å; I9-L18 WeakPolarHBondContact O-CD2 3.43Å; I9-Q20 HydrophobicContact CB-CB 4.38Å; I9-Q20 HydrophobicContact CG2-CB 3.65Å; I9-Q20 HydrophobicContact CG2-CG 3.83Å; I9-Y120 WeakPolarHBondContact CD1-O 3.47Å; I9-T121 WeakPolarHBondContact CD1-O 3.39Å; I9-S123 WeakPolarHBondContact CD1-O 3.39Å; I9-R126 WeakPolarHBondContact CD1-O 3.31Å; I9-P128 HydrophobicContact CG2-CG 4.17Å
10	T	82.4	Confident	83.3	Confident	59 Å²	59	82.4 Å²	82.4	36%	0.362	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-1.5	-178.9	47.1	0	0	0	0	112.9	A8 N124	A8-T10 PolarHBondContact O-N 3.34Å; T10-N124 WeakPolarHBondContact CG2-OD1 3.4Å; T10-N124 PolarHBondContact OG1-OD1 3.43Å
11	I	87	Confident	83.8	Confident	69 Å²	69	79.1 Å²	79.1	35%	0.354	41%	0.41	S	S	.	.			trans	-98.5	114	179.2	-63.7	175.1	0	0	0	108.3	Y5 A8	Y5-I11 HydrophobicContact CD1-CG2 3.7Å; Y5-I11 HydrophobicContact CG-CG2 4.48Å; A8-I11 HydrophobicContact CB-CD1 3.76Å; A8-I11 HydrophobicContact CB-CG1 3.94Å; A8-I11 PolarHBondContact O-N 3.28Å
12	F	88.8	Confident	85.9	Confident	117 Å²	117	71.6 Å²	71.6	51%	0.513	37%	0.372	S	S	.	.			trans	-78.6	141.3	172.1	-66.8	-93.9	0	0	0	110.2	Y5 H17 L18	Y5-F12 WeakPolarHBondContact CD1-O 3.45Å; F12-H17 WeakPolarHBondContact CA-O 3.49Å; F12-L18 HydrophobicContact CD1-CD2 3.67Å; F12-L18 HydrophobicContact CD1-CG 4.01Å; F12-L18 HydrophobicContact CD2-CD2 4.17Å; F12-L18 HydrophobicContact CE1-CD1 4.15Å; F12-L18 HydrophobicContact CE1-CD2 3.71Å; F12-L18 HydrophobicContact CE1-CG 3.76Å; F12-L18 HydrophobicContact CE2-CD2 4.19Å; F12-L18 HydrophobicContact CG-CD2 3.93Å; F12-L18 HydrophobicContact CZ-CD1 4.31Å; F12-L18 HydrophobicContact CZ-CD2 3.97Å; F12-L18 HydrophobicContact CZ-CG 4.28Å
13	S	90.1	Very high	87.3	Confident	6 Å²	6	73.6 Å²	73.6	4%	0.042	37%	0.37	C	S	.	.			trans	-69.5	165.6	167.2	65.7	0	0	0	0	111.2	D15 G16 H17	S13-D15 WeakPolarHBondContact CB-OD1 3.36Å; S13-D15 PolarHBondContact O-N 3.25Å; S13-D15 VanDerWaalsContact O-N 3.11Å; S13-D15 PolarHBondContact OG-OD1 3.05Å; S13-G16 PolarHBondContact O-N 2.9Å; S13-H17 PolarHBondContact N-O 3.38Å; S13-H17 WeakPolarHBondContact OG-CA 3.35Å; S13-H17 VanDerWaalsContact OG-CB 3.31Å; S13-H17 WeakPolarHBondContact OG-CB 3.44Å; S13-H17 PolarHBondContact OG-N 2.86Å; S13-H17 PolarHBondContact OG-O 3.45Å
14	P	91.7	Very high	88.5	Confident	109 Å²	109	69 Å²	69	71%	0.708	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-25.3	179.2	-26.5	36.4	0	0	0	114.8	Y5	Y5-P14 HydrophobicContact CE1-CG 4.37Å; Y5-P14 HydrophobicContact CE2-CG 3.92Å
15	D	91.5	Very high	89.3	Confident	104 Å²	104	64 Å²	64	56%	0.556	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	1	176.4	54.8	-34.9	0	0	0	113.8	S13 H17	S13-D15 WeakPolarHBondContact CB-OD1 3.36Å; S13-D15 PolarHBondContact O-N 3.25Å; S13-D15 VanDerWaalsContact O-N 3.11Å; S13-D15 PolarHBondContact OG-OD1 3.05Å; D15-H17 IonicContact OD2-CD2 2.75Å; D15-H17 PolarHBondContact OD2-CD2 3.36Å; D15-H17 IonicContact OD2-CG 2.69Å; D15-H17 IonicContact OD2-NE2 3.56Å
16	G	90.6	Very high	89.9	Confident	47 Å²	47	63.7 Å²	63.7	49%	0.485	32%	0.324	S	S	.	.	S	Bend	trans	88.7	14.9	174.9	0	0	0	0	0	115.1	S13	S13-G16 PolarHBondContact O-N 2.9Å
17	H	90.9	Very high	90.6	Very high	84 Å²	84	63.7 Å²	63.7	39%	0.389	33%	0.328	S	S	.	.			trans	-91.1	152.5	-179.4	-71.3	-114.2	0	0	0	112.5	F12 S13 D15 F19 E22	F12-H17 WeakPolarHBondContact CA-O 3.49Å; S13-H17 PolarHBondContact N-O 3.38Å; S13-H17 WeakPolarHBondContact OG-CA 3.35Å; S13-H17 VanDerWaalsContact OG-CB 3.31Å; S13-H17 WeakPolarHBondContact OG-CB 3.44Å; S13-H17 PolarHBondContact OG-N 2.86Å; S13-H17 PolarHBondContact OG-O 3.45Å; D15-H17 IonicContact OD2-CD2 2.75Å; D15-H17 PolarHBondContact OD2-CD2 3.36Å; D15-H17 IonicContact OD2-CG 2.69Å; D15-H17 IonicContact OD2-NE2 3.56Å; H17-F19 HydrophobicContact CB-CD1 4.31Å; H17-F19 HydrophobicContact CB-CE1 4.08Å; H17-E22 IonicContact CE1-OE1 3.71Å; H17-E22 IonicContact CG-OE1 3.77Å; H17-E22 IonicContact ND1-OE1 3.14Å; H17-E22 PolarHBondContact ND1-OE1 3.43Å
18	L	92.1	Very high	91.4	Very high	28 Å²	28	53.9 Å²	53.9	15%	0.147	29%	0.291	C	S	.	.			trans	-108.1	95.1	170.3	-69.2	-178.1	0	0	0	109.3	I9 F12 Q20 V21 E22	I9-L18 VanDerWaalsContact O-CD2 3.23Å; I9-L18 WeakPolarHBondContact O-CD2 3.43Å; F12-L18 HydrophobicContact CD1-CD2 3.67Å; F12-L18 HydrophobicContact CD1-CG 4.01Å; F12-L18 HydrophobicContact CD2-CD2 4.17Å; F12-L18 HydrophobicContact CE1-CD1 4.15Å; F12-L18 HydrophobicContact CE1-CD2 3.71Å; F12-L18 HydrophobicContact CE1-CG 3.76Å; F12-L18 HydrophobicContact CE2-CD2 4.19Å; F12-L18 HydrophobicContact CG-CD2 3.93Å; F12-L18 HydrophobicContact CZ-CD1 4.31Å; F12-L18 HydrophobicContact CZ-CD2 3.97Å; F12-L18 HydrophobicContact CZ-CG 4.28Å; L18-Q20 PolarHBondContact O-N 3.02Å; L18-Q20 VanDerWaalsContact O-N 3.13Å; L18-V21 HydrophobicContact CB-CB 4.18Å; L18-V21 HydrophobicContact CB-CG2 3.78Å; L18-V21 HydrophobicContact CD1-CG2 4.14Å; L18-V21 WeakPolarHBondContact O-CA 3.32Å; L18-V21 WeakPolarHBondContact O-CB 3.45Å; L18-V21 PolarHBondContact O-N 3.08Å; L18-E22 PolarHBondContact O-N 3.46Å
19	F	92.8	Very high	92.3	Very high	28 Å²	28	57.9 Å²	57.9	12%	0.123	30%	0.303	C	S	.	.	H	α-helix	trans	-60.1	-29.9	-173.8	-62.7	-41	0	0	0	114.2	D6 H17 V21 E22 Y23	D6-F19 HydrophobicContact CB-CB 4.49Å; D6-F19 HydrophobicContact CB-CD2 4.48Å; D6-F19 WeakPolarHBondContact OD1-CD2 3.48Å; D6-F19 WeakPolarHBondContact OD1-CE2 3.42Å; H17-F19 HydrophobicContact CB-CD1 4.31Å; H17-F19 HydrophobicContact CB-CE1 4.08Å; F19-V21 VanDerWaalsContact C-N 3.27Å; F19-V21 PolarHBondContact O-N 3.14Å; F19-E22 WeakPolarHBondContact O-CB 3.26Å; F19-E22 PolarHBondContact O-N 2.91Å; F19-Y23 HydrophobicContact CB-CE2 4.37Å; F19-Y23 WeakPolarHBondContact O-CD2 3.44Å; F19-Y23 PolarHBondContact O-N 2.88Å
20	Q	92.8	Very high	92.9	Very high	56 Å²	56	64.7 Å²	64.7	26%	0.262	33%	0.332	S	S	.	.	H	α-helix	trans	-65.2	-29.6	173.7	-72.3	-65	-38.1	0	0	113.4	D6 I9 L18 A24 P128	D6-Q20 PolarHBondContact O-NE2 3.36Å; I9-Q20 HydrophobicContact CB-CB 4.38Å; I9-Q20 HydrophobicContact CG2-CB 3.65Å; I9-Q20 HydrophobicContact CG2-CG 3.83Å; L18-Q20 PolarHBondContact O-N 3.02Å; L18-Q20 VanDerWaalsContact O-N 3.13Å; Q20-A24 PolarHBondContact O-N 2.9Å; Q20-P128 HydrophobicContact CB-CG 4.33Å
21	V	94.2	Very high	93.4	Very high	13 Å²	13	62.3 Å²	62.3	8%	0.079	32%	0.319	C	S	.	.	H	α-helix	trans	-73.3	-39.9	173.3	179.6	0	0	0	0	110.1	L18 F19 Y23 A24 Q25 T121 P128	L18-V21 HydrophobicContact CB-CB 4.18Å; L18-V21 HydrophobicContact CB-CG2 3.78Å; L18-V21 HydrophobicContact CD1-CG2 4.14Å; L18-V21 WeakPolarHBondContact O-CA 3.32Å; L18-V21 WeakPolarHBondContact O-CB 3.45Å; L18-V21 PolarHBondContact O-N 3.08Å; F19-V21 VanDerWaalsContact C-N 3.27Å; F19-V21 PolarHBondContact O-N 3.14Å; V21-Y23 PolarHBondContact O-N 3.03Å; V21-A24 WeakPolarHBondContact O-CB 3.41Å; V21-A24 PolarHBondContact O-N 3.33Å; V21-Q25 PolarHBondContact O-N 3.35Å; V21-T121 HydrophobicContact CG2-CG2 3.64Å; V21-P128 HydrophobicContact CG2-CG 4.19Å
22	E	94.5	Very high	93.8	Very high	65 Å²	65	59.5 Å²	59.5	30%	0.304	31%	0.306	S	S	.	.	H	α-helix	trans	-62.6	-42.8	175.3	-61.1	-174.8	176.5	0	0	111.5	H17 L18 F19 A24 Q25 E26	H17-E22 IonicContact CE1-OE1 3.71Å; H17-E22 IonicContact CG-OE1 3.77Å; H17-E22 IonicContact ND1-OE1 3.14Å; H17-E22 PolarHBondContact ND1-OE1 3.43Å; L18-E22 PolarHBondContact O-N 3.46Å; F19-E22 WeakPolarHBondContact O-CB 3.26Å; F19-E22 PolarHBondContact O-N 2.91Å; E22-A24 VanDerWaalsContact C-N 3.29Å; E22-A24 PolarHBondContact O-N 3.09Å; E22-Q25 CarbonylContact O-C 3.57Å; E22-Q25 WeakPolarHBondContact O-CB 3.29Å; E22-Q25 PolarHBondContact O-N 2.99Å; E22-Q25 VanDerWaalsContact O-N 3.1Å; E22-E26 WeakPolarHBondContact O-CG 3.44Å; E22-E26 PolarHBondContact O-N 3.03Å
23	Y	94.8	Very high	94.2	Very high	108 Å²	108	54 Å²	54	42%	0.424	28%	0.281	S	S	.	.	H	α-helix	trans	-62	-36.2	174	-59.8	-24.4	0	0	0	112.8	D6 F19 V21 E26 A27	D6-Y23 HydrophobicContact CB-CE2 4.14Å; D6-Y23 PolarHBondContact OD2-OH 3.39Å; F19-Y23 HydrophobicContact CB-CE2 4.37Å; F19-Y23 WeakPolarHBondContact O-CD2 3.44Å; F19-Y23 PolarHBondContact O-N 2.88Å; V21-Y23 PolarHBondContact O-N 3.03Å; Y23-E26 PolarHBondContact O-N 3.19Å; Y23-A27 PolarHBondContact O-N 2.99Å
24	A	96.3	Very high	94.5	Very high	8 Å²	8	53.7 Å²	53.7	7%	0.066	28%	0.279	C	S	.	.	H	α-helix	trans	-65.7	-39	173.6	0	0	0	0	0	111.6	Q20 V21 E22 A27 V28 P128 P151	Q20-A24 PolarHBondContact O-N 2.9Å; V21-A24 WeakPolarHBondContact O-CB 3.41Å; V21-A24 PolarHBondContact O-N 3.33Å; E22-A24 VanDerWaalsContact C-N 3.29Å; E22-A24 PolarHBondContact O-N 3.09Å; A24-A27 WeakPolarHBondContact O-CB 3.26Å; A24-A27 PolarHBondContact O-N 3.48Å; A24-V28 PolarHBondContact O-N 3.36Å; A24-P128 HydrophobicContact CB-CB 3.93Å; A24-P151 HydrophobicContact CB-CB 3.86Å; A24-P151 HydrophobicContact CB-CG 4.32Å
25	Q	96.5	Very high	94.9	Very high	65 Å²	65	48.5 Å²	48.5	30%	0.304	25%	0.245	S	C	.	.	H	α-helix	trans	-66	-36.5	172.4	-69.9	177.4	-18.8	0	0	112.2	V21 E22 A27 V28 K29 P151	V21-Q25 PolarHBondContact O-N 3.35Å; E22-Q25 CarbonylContact O-C 3.57Å; E22-Q25 WeakPolarHBondContact O-CB 3.29Å; E22-Q25 PolarHBondContact O-N 2.99Å; E22-Q25 VanDerWaalsContact O-N 3.1Å; Q25-A27 VanDerWaalsContact C-N 3.28Å; Q25-A27 PolarHBondContact O-N 3.08Å; Q25-V28 VanDerWaalsContact O-CB 3.3Å; Q25-V28 WeakPolarHBondContact O-CB 3.19Å; Q25-V28 PolarHBondContact O-N 3.42Å; Q25-V28 VanDerWaalsContact O-N 3.09Å; Q25-K29 PolarHBondContact O-N 3.43Å; Q25-K29 VanDerWaalsContact O-N 3.11Å; Q25-P151 HydrophobicContact CG-CB 4.18Å; Q25-P151 HydrophobicContact CG-CG 4.03Å
26	E	96.6	Very high	95.2	Very high	81 Å²	81	43.5 Å²	43.5	38%	0.379	22%	0.219	S	C	.	.	H	α-helix	trans	-63.5	-34.4	172.3	-71.2	-53.4	124.6	0	0	112.2	E22 Y23 V28 K29 K30	E22-E26 WeakPolarHBondContact O-CG 3.44Å; E22-E26 PolarHBondContact O-N 3.03Å; Y23-E26 PolarHBondContact O-N 3.19Å; E26-V28 VanDerWaalsContact C-N 3.3Å; E26-V28 PolarHBondContact O-N 3.3Å; E26-K29 PolarHBondContact O-N 3.02Å; E26-K29 WeakPolarHBondContact OE1-CD 3.42Å; E26-K29 WeakPolarHBondContact OE1-CE 3.4Å; E26-K29 IonicContact OE1-NZ 3.33Å; E26-K29 PolarHBondContact OE1-NZ 3.44Å; E26-K30 WeakPolarHBondContact O-CG 3.35Å; E26-K30 PolarHBondContact O-N 2.99Å
27	A	96.6	Very high	95.6	Very high	27 Å²	27	41.3 Å²	41.3	22%	0.223	20%	0.196	C	C	.	.	H	α-helix	trans	-64.2	-35.6	172	0	0	0	0	0	112.1	Y23 A24 Q25 K30 G31 L78	Y23-A27 PolarHBondContact O-N 2.99Å; A24-A27 WeakPolarHBondContact O-CB 3.26Å; A24-A27 PolarHBondContact O-N 3.48Å; Q25-A27 VanDerWaalsContact C-N 3.28Å; Q25-A27 PolarHBondContact O-N 3.08Å; A27-K30 PolarHBondContact O-N 3.15Å; A27-G31 PolarHBondContact O-N 2.95Å; A27-L78 HydrophobicContact CB-CG 4.48Å
28	V	97.7	Very high	96	Very high	9 Å²	9	40.1 Å²	40.1	6%	0.055	19%	0.188	C	C	.	.	H	α-helix	trans	-62.2	-47.7	173.4	178.8	0	0	0	0	110.9	A24 Q25 E26 K30 G31 A76 S132 P151 G164	A24-V28 PolarHBondContact O-N 3.36Å; Q25-V28 VanDerWaalsContact O-CB 3.3Å; Q25-V28 WeakPolarHBondContact O-CB 3.19Å; Q25-V28 PolarHBondContact O-N 3.42Å; Q25-V28 VanDerWaalsContact O-N 3.09Å; E26-V28 VanDerWaalsContact C-N 3.3Å; E26-V28 PolarHBondContact O-N 3.3Å; V28-K30 PolarHBondContact O-N 2.95Å; V28-K30 VanDerWaalsContact O-N 3.09Å; V28-G31 PolarHBondContact O-N 3.02Å; V28-A76 HydrophobicContact CG1-CB 4.09Å; V28-S132 WeakPolarHBondContact CG1-OG 3.36Å; V28-P151 HydrophobicContact CG2-CG 3.83Å; V28-G164 WeakPolarHBondContact O-CA 3.49Å
29	K	96.8	Very high	96.2	Very high	117 Å²	117	39 Å²	39	51%	0.509	18%	0.183	S	C	.	.	H	α-helix	trans	-60.4	-20.7	179.7	-66.6	176.6	-172	168.2	0	113.3	Q25 E26 K165	Q25-K29 PolarHBondContact O-N 3.43Å; Q25-K29 VanDerWaalsContact O-N 3.11Å; E26-K29 PolarHBondContact O-N 3.02Å; E26-K29 WeakPolarHBondContact OE1-CD 3.42Å; E26-K29 WeakPolarHBondContact OE1-CE 3.4Å; E26-K29 IonicContact OE1-NZ 3.33Å; E26-K29 PolarHBondContact OE1-NZ 3.44Å; K29-K165 WeakPolarHBondContact O-CA 3.47Å; K29-K165 WeakPolarHBondContact O-CB 3.34Å; K29-K165 PolarHBondContact O-N 3.38Å
30	K	95.5	Very high	96.3	Very high	159 Å²	159	44.5 Å²	44.5	69%	0.691	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	-13.8	174.3	-66.5	174.5	-176.2	176.2	0	113.8	E26 A27 V28	E26-K30 WeakPolarHBondContact O-CG 3.35Å; E26-K30 PolarHBondContact O-N 2.99Å; A27-K30 PolarHBondContact O-N 3.15Å; V28-K30 PolarHBondContact O-N 2.95Å; V28-K30 VanDerWaalsContact O-N 3.09Å
31	G	94.6	Very high	96.3	Very high	9 Å²	9	46.3 Å²	46.3	9%	0.093	22%	0.219	C	C	.	.	S	Bend	trans	-73.7	154.4	176.5	0	0	0	0	0	112.3	A27 V28 K165	A27-G31 PolarHBondContact O-N 2.95Å; V28-G31 PolarHBondContact O-N 3.02Å; G31-K165 WeakPolarHBondContact O-CB 3.48Å; G31-K165 PolarHBondContact O-N 3.05Å
32	S	94.4	Very high	96.5	Very high	10 Å²	10	45.9 Å²	45.9	7%	0.07	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-60.9	148.1	176.6	-2.4	0	0	0	0	111.7	E48 K63	S32-E48 VanDerWaalsContact CA-OE2 3.32Å; S32-E48 WeakPolarHBondContact CA-OE2 3.43Å; S32-E48 VanDerWaalsContact CB-O 3.29Å; S32-E48 WeakPolarHBondContact CB-O 3.19Å; S32-E48 VanDerWaalsContact CB-OE2 3.23Å; S32-E48 WeakPolarHBondContact CB-OE2 3.36Å; S32-K63 VanDerWaalsContact CB-NZ 3.26Å; S32-K63 PolarHBondContact O-NZ 3.48Å; S32-K63 PolarHBondContact OG-NZ 2.91Å
33	T	96.7	Very high	96.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-61.8	142.3	-176.5	-41.4	0	0	0	0	111.6	I35 E48 I163 K165 L197 V200	T33-I35 HydrophobicContact CG2-CG1 4.26Å; T33-E48 PolarHBondContact N-OE2 2.96Å; T33-E48 PolarHBondContact O-N 3.2Å; T33-I163 CarbonylContact C-O 2.96Å; T33-I163 WeakPolarHBondContact CA-O 3.35Å; T33-K165 PolarHBondContact OG1-O 3.41Å; T33-L197 HydrophobicContact CG2-CD1 4.2Å; T33-V200 HydrophobicContact CG2-CG2 4.02Å
34	A	97.9	Very high	96.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	138.3	167.7	0	0	0	0	0	109.2	V47 A74 L134 A162 I163	A34-V47 HydrophobicContact CB-CB 4.26Å; A34-V47 HydrophobicContact CB-CG1 3.61Å; A34-A74 HydrophobicContact CB-CB 4.18Å; A34-L134 HydrophobicContact CB-CD1 4.47Å; A34-A162 CarbonylContact O-C 3.57Å; A34-A162 VanDerWaalsContact O-CA 3.32Å; A34-A162 WeakPolarHBondContact O-CA 3.3Å; A34-I163 HydrophobicContact CB-CD1 4.29Å; A34-I163 HydrophobicContact CB-CG1 3.83Å; A34-I163 PolarHBondContact N-O 3.48Å; A34-I163 PolarHBondContact O-N 3.12Å
35	I	98.5	Very high	97	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	137	-176.8	-59.5	-175	0	0	0	108.4	T33 V37 L45 C46 N161 A162 A170 L174 A196 L197	T33-I35 HydrophobicContact CG2-CG1 4.26Å; I35-V37 HydrophobicContact CG2-CG2 4.02Å; I35-L45 WeakPolarHBondContact O-CA 3.38Å; I35-C46 PolarHBondContact N-O 2.88Å; I35-C46 PolarHBondContact O-N 2.98Å; I35-N161 WeakPolarHBondContact CA-O 3.25Å; I35-A162 HydrophobicContact CG1-CB 4.08Å; I35-A170 HydrophobicContact CD1-CB 4.06Å; I35-L174 HydrophobicContact CG2-CD1 4.07Å; I35-A196 HydrophobicContact CD1-CB 3.58Å; I35-A196 HydrophobicContact CG2-CB 4.41Å; I35-L197 VanDerWaalsContact CD1-CA 3.5Å; I35-L197 HydrophobicContact CD1-CB 3.79Å; I35-L197 HydrophobicContact CD1-CD1 4.06Å; I35-L197 HydrophobicContact CG1-CD1 4.38Å
36	G	98.7	Very high	97	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	135.6	171.9	0	0	0	0	0	109.3	V44 L146 A160 N161	G36-V44 VanDerWaalsContact CA-O 3.31Å; G36-V44 WeakPolarHBondContact CA-O 3.25Å; G36-L146 VanDerWaalsContact C-CD2 3.46Å; G36-L146 VanDerWaalsContact O-CD2 3.31Å; G36-L146 WeakPolarHBondContact O-CD2 3.41Å; G36-A160 CarbonylContact O-C 3.59Å; G36-A160 VanDerWaalsContact O-CA 3.26Å; G36-A160 WeakPolarHBondContact O-CA 3.33Å; G36-N161 PolarHBondContact N-O 2.93Å; G36-N161 PolarHBondContact O-N 2.9Å
37	V	98.8	Very high	97	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.006	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	129.9	176.9	-173.9	0	0	0	0	108.7	I35 V44 A160 L174 Y178 V183 T189 L192 A193	I35-V37 HydrophobicContact CG2-CG2 4.02Å; V37-V44 PolarHBondContact N-O 2.77Å; V37-V44 PolarHBondContact O-N 3.5Å; V37-A160 HydrophobicContact CB-CB 4.42Å; V37-A160 HydrophobicContact CG1-CB 4.22Å; V37-A160 HydrophobicContact CG2-CB 4.2Å; V37-L174 HydrophobicContact CG2-CD2 4.07Å; V37-Y178 HydrophobicContact CG1-CD2 4.25Å; V37-Y178 HydrophobicContact CG1-CE2 4.05Å; V37-V183 HydrophobicContact CG1-CG1 4.07Å; V37-T189 HydrophobicContact CB-CG2 4.08Å; V37-T189 HydrophobicContact CG1-CG2 3.68Å; V37-L192 HydrophobicContact CG1-CD2 4.07Å; V37-A193 HydrophobicContact CB-CB 4.46Å; V37-A193 HydrophobicContact CG2-CB 3.74Å
38	R	98.4	Very high	96.9	Very high	59 Å²	59	31 Å²	31	22%	0.223	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	121.7	169.1	-177.3	165.8	77.5	169.3	5.9	109.5	V43 P144 E157 L159 Y178	R38-V43 HydrophobicContact CG-CG1 4.38Å; R38-P144 WeakPolarHBondContact CD-O 3.42Å; R38-P144 HydrophobicContact CG-CB 3.84Å; R38-P144 HydrophobicContact CG-CG 3.91Å; R38-P144 PolarHBondContact NH1-O 2.9Å; R38-E157 IonicContact NH1-OE1 3.78Å; R38-L159 WeakPolarHBondContact CB-O 3.48Å; R38-L159 PolarHBondContact N-O 2.93Å; R38-Y178 WeakPolarHBondContact O-CE2 3.31Å; R38-Y178 PolarHBondContact O-OH 3.37Å; R38-Y178 VanDerWaalsContact O-OH 3.1Å
39	G	97.8	Very high	96.5	Very high	3 Å²	3	32.3 Å²	32.3	3%	0.031	15%	0.149	C	C	.	.			trans	-98.1	-178.3	164.5	0	0	0	0	0	111.6	C42 T189	G39-C42 CarbonylContact C-O 3.58Å; G39-C42 VanDerWaalsContact CA-O 3.27Å; G39-C42 WeakPolarHBondContact CA-O 3.43Å; G39-C42 PolarHBondContact N-O 3Å; G39-T189 WeakPolarHBondContact CA-OG1 3.22Å
40	K	93.8	Very high	95.9	Very high	144 Å²	144	32.7 Å²	32.7	63%	0.626	15%	0.151	S	C	*	.	S	Bend	trans	-63.9	-53.5	178	-173.8	-177.9	176.9	-176.1	0	112.2	V183	K40-V183 PolarHBondContact N-O 3.14Å; K40-V183 VanDerWaalsContact N-O 3.09Å
41	D	93	Very high	95.2	Very high	95 Å²	95	28.7 Å²	28.7	51%	0.508	15%	0.147	S	C	.	.	S	Bend	trans	-116.2	7.6	-174.8	-57.1	-51.3	0	0	0	112.7	W215	D41-W215 PolarHBondContact O-N 3.02Å; D41-W215 VanDerWaalsContact O-N 3.09Å
42	C	97.8	Very high	94.6	Very high	3 Å²	3	30.3 Å²	30.3	2%	0.02	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	160.4	178.5	72	0	0	0	0	112.8	G39 V212 M213 R214	G39-C42 CarbonylContact C-O 3.58Å; G39-C42 VanDerWaalsContact CA-O 3.27Å; G39-C42 WeakPolarHBondContact CA-O 3.43Å; G39-C42 PolarHBondContact N-O 3Å; C42-V212 HydrophobicContact CB-CG1 4.01Å; C42-M213 CarbonylContact C-O 3.58Å; C42-M213 WeakPolarHBondContact CA-O 3.41Å; C42-M213 WeakPolarHBondContact CB-O 3.48Å; C42-R214 HydrophobicContact CB-CG 4.5Å
43	V	98.6	Very high	94.2	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	139.4	163.7	-64.9	0	0	0	0	109.3	R38 C136 F138 P144 M213	R38-V43 HydrophobicContact CG-CG1 4.38Å; V43-C136 HydrophobicContact CB-CB 4.14Å; V43-C136 HydrophobicContact CG2-CB 3.99Å; V43-F138 HydrophobicContact CG1-CE2 4.49Å; V43-F138 HydrophobicContact CG2-CE2 4.15Å; V43-P144 HydrophobicContact CG1-CB 3.61Å; V43-M213 HydrophobicContact CG2-CB 3.68Å; V43-M213 PolarHBondContact N-O 2.79Å; V43-M213 PolarHBondContact O-N 3.21Å
44	V	98.7	Very high	93.7	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	132.9	-173.4	-176.4	0	0	0	0	110.1	G36 V37 T189 V190 A193 L210 A211 V212	G36-V44 VanDerWaalsContact CA-O 3.31Å; G36-V44 WeakPolarHBondContact CA-O 3.25Å; V37-V44 PolarHBondContact N-O 2.77Å; V37-V44 PolarHBondContact O-N 3.5Å; V44-T189 HydrophobicContact CB-CG2 4.31Å; V44-T189 HydrophobicContact CG2-CG2 3.57Å; V44-V190 HydrophobicContact CG1-CG2 4.24Å; V44-V190 HydrophobicContact CG2-CG2 3.79Å; V44-A193 HydrophobicContact CB-CB 4.45Å; V44-A193 HydrophobicContact CG1-CB 3.85Å; V44-L210 HydrophobicContact CG1-CD2 3.82Å; V44-L210 HydrophobicContact CG1-CG 4.37Å; V44-A211 WeakPolarHBondContact CA-O 3.43Å; V44-V212 HydrophobicContact CG1-CG2 4.4Å; V44-V212 HydrophobicContact CG2-CG1 4.47Å; V44-V212 HydrophobicContact CG2-CG2 4.13Å
45	L	98.8	Very high	93.5	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	127.2	167.5	-68.1	175.6	0	0	0	109.2	I35 I64 A72 A74 L134 C136 L210 A211	I35-L45 WeakPolarHBondContact O-CA 3.38Å; L45-I64 HydrophobicContact CB-CD1 3.79Å; L45-I64 HydrophobicContact CB-CG1 4.43Å; L45-I64 HydrophobicContact CD1-CG2 4.02Å; L45-A72 HydrophobicContact CD1-CB 4Å; L45-A74 HydrophobicContact CB-CB 4.46Å; L45-A74 HydrophobicContact CD1-CB 3.98Å; L45-A74 HydrophobicContact CD2-CB 3.97Å; L45-A74 HydrophobicContact CG-CB 4.37Å; L45-L134 HydrophobicContact CD2-CB 4.14Å; L45-C136 VanDerWaalsContact CD1-SG 3.55Å; L45-C136 VanDerWaalsContact CG-SG 3.5Å; L45-L210 CarbonylContact O-C 3.5Å; L45-L210 WeakPolarHBondContact O-CA 3.36Å; L45-A211 PolarHBondContact N-O 3.31Å; L45-A211 PolarHBondContact O-N 3.32Å
46	C	97.9	Very high	93.1	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	118.3	178.6	-170	0	0	0	0	109.2	I35 A193 L197 L210	I35-C46 PolarHBondContact N-O 2.88Å; I35-C46 PolarHBondContact O-N 2.98Å; C46-A193 HydrophobicContact CB-CB 3.99Å; C46-L197 WeakPolarHBondContact SG-CD2 3.14Å; C46-L210 HydrophobicContact CB-CD1 4.39Å; C46-L210 HydrophobicContact CB-CG 4.19Å
47	V	96.7	Very high	92.5	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	142.2	-172.1	-51.6	0	0	0	0	112	A34 K49 K63 I64 A74 M208 E209	A34-V47 HydrophobicContact CB-CB 4.26Å; A34-V47 HydrophobicContact CB-CG1 3.61Å; V47-K49 PolarHBondContact O-N 3.45Å; V47-K63 HydrophobicContact CG2-CB 4.07Å; V47-I64 HydrophobicContact CG1-CD1 4.08Å; V47-I64 HydrophobicContact CG1-CG1 3.81Å; V47-I64 HydrophobicContact CG2-CD1 4.1Å; V47-I64 HydrophobicContact CG2-CG1 3.87Å; V47-A74 HydrophobicContact CG1-CB 3.68Å; V47-M208 WeakPolarHBondContact O-CA 3.14Å; V47-E209 HydrophobicContact CG2-CB 3.59Å; V47-E209 HydrophobicContact CG2-CG 4.05Å; V47-E209 WeakPolarHBondContact CG2-O 3.47Å; V47-E209 PolarHBondContact N-O 2.91Å; V47-E209 PolarHBondContact O-N 2.94Å
48	E	94.6	Very high	91.8	Very high	40 Å²	40	64.7 Å²	64.7	19%	0.187	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	117.2	171.6	-178.8	-165.5	174.2	0	0	109.9	S32 T33 L197 V201	S32-E48 VanDerWaalsContact CA-OE2 3.32Å; S32-E48 WeakPolarHBondContact CA-OE2 3.43Å; S32-E48 VanDerWaalsContact CB-O 3.29Å; S32-E48 WeakPolarHBondContact CB-O 3.19Å; S32-E48 VanDerWaalsContact CB-OE2 3.23Å; S32-E48 WeakPolarHBondContact CB-OE2 3.36Å; T33-E48 PolarHBondContact N-OE2 2.96Å; T33-E48 PolarHBondContact O-N 3.2Å; E48-L197 HydrophobicContact CB-CD1 4.26Å; E48-V201 HydrophobicContact CB-CG2 3.86Å; E48-V201 HydrophobicContact CG-CG1 4.26Å; E48-V201 HydrophobicContact CG-CG2 3.64Å
49	K	89.4	Confident	91	Very high	36 Å²	36	71.2 Å²	71.2	16%	0.157	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-92.1	122.8	170.3	-171.1	-177.7	-176.7	-179.2	0	109.2	V47 D58 Y207	V47-K49 PolarHBondContact O-N 3.45Å; K49-D58 VanDerWaalsContact CE-O 3.29Å; K49-D58 WeakPolarHBondContact CE-O 3.45Å; K49-D58 PolarHBondContact NZ-O 3.44Å; K49-D58 IonicContact NZ-OD2 3.14Å; K49-D58 PolarHBondContact NZ-OD2 3.04Å; K49-Y207 PolarHBondContact N-O 3.27Å
50	K	83.7	Confident	90.4	Very high	124 Å²	124	76 Å²	76	54%	0.539	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-68.7	145.7	174.8	-70.3	-170.7	177	-175.9	0	110.7	T52	K50-T52 PolarHBondContact O-N 3.36Å
51	A	79.4	Confident	90	Very high	75 Å²	75	71.4 Å²	71.4	62%	0.62	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-54.6	121.1	168.9	0	0	0	0	0	110	Y207	A51-Y207 HydrophobicContact CB-CD1 4.38Å; A51-Y207 HydrophobicContact CB-CE1 3.78Å
52	T	82.4	Confident	89.9	Confident	44 Å²	44	74.3 Å²	74.3	27%	0.27	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-86.5	149.5	172.7	48.4	0	0	0	0	109.9	K50 Q56 D58 V61	K50-T52 PolarHBondContact O-N 3.36Å; T52-Q56 HydrophobicContact CG2-CG 4.26Å; T52-D58 HydrophobicContact CG2-CB 4.34Å; T52-D58 VanDerWaalsContact OG1-CB 3.32Å; T52-D58 WeakPolarHBondContact OG1-CB 3.31Å; T52-V61 HydrophobicContact CG2-CB 4.48Å; T52-V61 HydrophobicContact CG2-CG2 3.96Å
53	T	85.9	Confident	89.7	Confident	95 Å²	95	74.9 Å²	74.9	58%	0.583	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-66.6	155.8	175	61.3	0	0	0	0	110	L55 Q56	T53-L55 PolarHBondContact O-N 2.57Å; T53-Q56 PolarHBondContact O-N 3.49Å; T53-Q56 WeakPolarHBondContact OG1-CB 3.31Å
54	K	87.3	Confident	89.7	Confident	214 Å²	214	75.2 Å²	75.2	93%	0.93	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-30.8	-177.9	-174.3	178.6	178	-177.5	0	113.7
55	L	93.7	Very high	89.6	Confident	173 Å²	173	76.1 Å²	76.1	91%	0.906	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-11.5	-179.5	-60	179.6	0	0	0	113.3	T53	T53-L55 PolarHBondContact O-N 2.57Å
56	Q	89.3	Confident	89.6	Confident	91 Å²	91	78.3 Å²	78.3	43%	0.425	39%	0.392	S	S	.	.	S	Bend	trans	-88	128.8	177.9	-176.7	175.5	17.4	0	0	109.9	T52 T53 D58	T52-Q56 HydrophobicContact CG2-CG 4.26Å; T53-Q56 PolarHBondContact O-N 3.49Å; T53-Q56 WeakPolarHBondContact OG1-CB 3.31Å; Q56-D58 PolarHBondContact O-N 3.02Å
57	N	86.2	Confident	89.6	Confident	90 Å²	90	78.6 Å²	78.6	48%	0.481	39%	0.394	S	S	.	.			trans	-67.3	116.7	171.9	-170.3	-25	0	0	0	109.5	R59 T60	N57-R59 VanDerWaalsContact C-N 3.26Å; N57-R59 PolarHBondContact O-N 2.79Å; N57-R59 VanDerWaalsContact OD1-CB 3.32Å; N57-R59 WeakPolarHBondContact OD1-CB 3.38Å; N57-R59 PolarHBondContact OD1-N 2.91Å; N57-T60 HydrophobicContact CB-CG2 4.2Å; N57-T60 PolarHBondContact O-OG1 3.2Å
58	D	83.9	Confident	89.7	Confident	69 Å²	69	79.5 Å²	79.5	37%	0.369	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-73.6	-19.4	-176	81.7	-39.6	0	0	0	112.9	K49 T52 Q56 T60 V61	K49-D58 VanDerWaalsContact CE-O 3.29Å; K49-D58 WeakPolarHBondContact CE-O 3.45Å; K49-D58 PolarHBondContact NZ-O 3.44Å; K49-D58 IonicContact NZ-OD2 3.14Å; K49-D58 PolarHBondContact NZ-OD2 3.04Å; T52-D58 HydrophobicContact CG2-CB 4.34Å; T52-D58 VanDerWaalsContact OG1-CB 3.32Å; T52-D58 WeakPolarHBondContact OG1-CB 3.31Å; Q56-D58 PolarHBondContact O-N 3.02Å; D58-T60 PolarHBondContact O-N 3.28Å; D58-V61 PolarHBondContact O-N 2.63Å
59	R	83.1	Confident	89.8	Confident	196 Å²	196	82.4 Å²	82.4	74%	0.74	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-71.4	-20.2	180	-60.3	-177.3	174.7	-178.6	-3.3	113	N57	N57-R59 VanDerWaalsContact C-N 3.26Å; N57-R59 PolarHBondContact O-N 2.79Å; N57-R59 VanDerWaalsContact OD1-CB 3.32Å; N57-R59 WeakPolarHBondContact OD1-CB 3.38Å; N57-R59 PolarHBondContact OD1-N 2.91Å
60	T	85	Confident	90.2	Very high	104 Å²	104	80.9 Å²	80.9	64%	0.638	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-86.6	-11.5	-178.6	64.6	0	0	0	0	113	N57 D58	N57-T60 HydrophobicContact CB-CG2 4.2Å; N57-T60 PolarHBondContact O-OG1 3.2Å; D58-T60 PolarHBondContact O-N 3.28Å
61	V	85	Confident	90.9	Very high	47 Å²	47	75 Å²	75	29%	0.285	38%	0.383	S	S	.	.			trans	-98.1	96.2	178.8	-174.7	0	0	0	0	108.7	T52 D58	T52-V61 HydrophobicContact CG2-CB 4.48Å; T52-V61 HydrophobicContact CG2-CG2 3.96Å; D58-V61 PolarHBondContact O-N 2.63Å
62	R	89.9	Confident	91.8	Very high	156 Å²	156	71.4 Å²	71.4	59%	0.589	35%	0.354	S	S	*	.			trans	-120.2	141	176.3	-61.2	-170.1	-174.7	-166.4	-3.6	110.9	E209	R62-E209 WeakPolarHBondContact CB-OE1 3.4Å
63	K	95.2	Very high	92.6	Very high	16 Å²	16	69.3 Å²	69.3	7%	0.07	34%	0.341	C	S	.	.	S	Bend	trans	-115.9	-7.8	174.6	-61	-177.6	77.7	-162	0	112.6	S32 V47 A74 F75 E209	S32-K63 VanDerWaalsContact CB-NZ 3.26Å; S32-K63 PolarHBondContact O-NZ 3.48Å; S32-K63 PolarHBondContact OG-NZ 2.91Å; V47-K63 HydrophobicContact CG2-CB 4.07Å; K63-A74 WeakPolarHBondContact O-CA 3.4Å; K63-F75 HydrophobicContact CB-CE1 4.15Å; K63-F75 HydrophobicContact CB-CZ 4.12Å; K63-F75 WeakPolarHBondContact CE-O 3.39Å; K63-F75 HydrophobicContact CG-CE2 4.31Å; K63-F75 HydrophobicContact CG-CZ 4.03Å; K63-F75 PolarHBondContact NZ-O 3.48Å; K63-F75 WeakPolarHBondContact O-CD1 3.32Å; K63-F75 WeakPolarHBondContact O-CE1 3.37Å; K63-F75 PolarHBondContact O-N 3.09Å; K63-E209 PolarHBondContact N-OE2 3.11Å
64	I	97.8	Very high	93.2	Very high	8 Å²	8	64.8 Å²	64.8	4%	0.041	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	135.3	169.6	-53.8	-178	0	0	0	109.3	L45 V47 V73 A74 E209 A211 W228 M230	L45-I64 HydrophobicContact CB-CD1 3.79Å; L45-I64 HydrophobicContact CB-CG1 4.43Å; L45-I64 HydrophobicContact CD1-CG2 4.02Å; V47-I64 HydrophobicContact CG1-CD1 4.08Å; V47-I64 HydrophobicContact CG1-CG1 3.81Å; V47-I64 HydrophobicContact CG2-CD1 4.1Å; V47-I64 HydrophobicContact CG2-CG1 3.87Å; I64-V73 CarbonylContact C-O 3.57Å; I64-V73 WeakPolarHBondContact CA-O 3.26Å; I64-A74 HydrophobicContact CG1-CB 4.35Å; I64-E209 HydrophobicContact CD1-CG 3.94Å; I64-E209 HydrophobicContact CG1-CG 4.14Å; I64-E209 PolarHBondContact N-OE2 3.4Å; I64-A211 HydrophobicContact CD1-CB 3.91Å; I64-A211 HydrophobicContact CG2-CB 4.05Å; I64-W228 HydrophobicContact CG2-CH2 3.68Å; I64-W228 HydrophobicContact CG2-CZ2 3.73Å; I64-M230 HydrophobicContact CB-CE 4.33Å; I64-M230 HydrophobicContact CB-SD 4.48Å; I64-M230 HydrophobicContact CD1-CE 4.38Å; I64-M230 HydrophobicContact CG2-SD 4.25Å
65	A	97.5	Very high	93.7	Very high	20 Å²	20	54.9 Å²	54.9	17%	0.165	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	149.1	176.3	0	0	0	0	0	111.5	A72 V73 I86	A65-A72 CarbonylContact O-C 3.58Å; A65-V73 HydrophobicContact CB-CG1 4.32Å; A65-V73 PolarHBondContact N-O 3.16Å; A65-V73 WeakPolarHBondContact O-CG1 3.44Å; A65-V73 PolarHBondContact O-N 3.06Å; A65-I86 HydrophobicContact CB-CD1 4.06Å; A65-I86 HydrophobicContact CB-CG2 4.44Å
66	L	98.3	Very high	93.9	Very high	47 Å²	47	46.7 Å²	46.7	25%	0.246	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	134.9	166.6	-68.5	174.1	0	0	0	110.6	V71 A72 R90 M213 W228	L66-V71 CarbonylContact C-O 3.58Å; L66-V71 WeakPolarHBondContact CA-O 3.45Å; L66-A72 HydrophobicContact CD2-CB 4.06Å; L66-R90 PolarHBondContact O-NE 3.01Å; L66-R90 PolarHBondContact O-NH2 2.93Å; L66-M213 HydrophobicContact CD2-CE 3.92Å; L66-W228 HydrophobicContact CD1-CG 4.13Å; L66-W228 HydrophobicContact CD2-CD2 3.74Å; L66-W228 HydrophobicContact CD2-CE3 4.13Å; L66-W228 HydrophobicContact CD2-CG 4Å; L66-W228 HydrophobicContact CD2-CZ2 4.22Å; L66-W228 HydrophobicContact CG-CD2 4.39Å; L66-W228 HydrophobicContact CG-CG 4.43Å
67	L	98.3	Very high	94.2	Very high	6 Å²	6	42.9 Å²	42.9	3%	0.031	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-36.3	168.9	-64.3	177.2	0	0	0	111	V71 V73 I86 I89 R90 I109 M113 I135	L67-V71 HydrophobicContact CB-CB 4.12Å; L67-V71 HydrophobicContact CB-CG1 3.86Å; L67-V71 HydrophobicContact CD1-CG1 3.87Å; L67-V71 HydrophobicContact CG-CG1 4.34Å; L67-V71 PolarHBondContact N-O 3.47Å; L67-V73 HydrophobicContact CD1-CB 3.84Å; L67-V73 HydrophobicContact CD1-CG1 4.02Å; L67-V73 HydrophobicContact CD2-CG1 3.77Å; L67-V73 HydrophobicContact CG-CB 4.03Å; L67-V73 HydrophobicContact CG-CG1 3.72Å; L67-I86 HydrophobicContact CD2-CB 4.23Å; L67-I86 HydrophobicContact CD2-CG1 4.13Å; L67-I86 HydrophobicContact CD2-CG2 4.06Å; L67-I89 HydrophobicContact CB-CG2 4.25Å; L67-I89 HydrophobicContact CD1-CG2 3.77Å; L67-I89 HydrophobicContact CD2-CB 4.01Å; L67-I89 HydrophobicContact CD2-CG2 3.96Å; L67-I89 HydrophobicContact CG-CG2 4.21Å; L67-R90 WeakPolarHBondContact O-CG 3.34Å; L67-I109 HydrophobicContact CD1-CG2 4.08Å; L67-M113 HydrophobicContact CD1-CE 4.14Å; L67-I135 HydrophobicContact CD1-CG2 4.34Å
68	D	97.6	Very high	94.7	Very high	18 Å²	18	42.3 Å²	42.3	10%	0.096	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	176.2	168.9	-156	-2.9	0	0	0	107.8	H70 V71 C93	D68-H70 PolarHBondContact O-N 3.42Å; D68-H70 IonicContact OD2-CE1 2.7Å; D68-H70 PolarHBondContact OD2-CE1 3.19Å; D68-H70 VanDerWaalsContact OD2-CE1 3.31Å; D68-H70 IonicContact OD2-ND1 3.45Å; D68-V71 HydrophobicContact CB-CB 4.14Å; D68-V71 HydrophobicContact CB-CG2 4.08Å; D68-V71 PolarHBondContact N-O 2.87Å; D68-V71 PolarHBondContact O-N 3.3Å; D68-V71 VanDerWaalsContact O-N 3.13Å; D68-C93 HydrophobicContact CB-CB 3.98Å
69	D	96.2	Very high	95.3	Very high	101 Å²	101	42.6 Å²	42.6	54%	0.54	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-36.6	-177.1	-65.1	-27.1	0	0	0	112.4	V226	D69-V226 VanDerWaalsContact O-CG2 3.29Å; D69-V226 WeakPolarHBondContact O-CG2 3.32Å
70	H	97.6	Very high	95.9	Very high	5 Å²	5	35.6 Å²	35.6	2%	0.023	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	8.7	179.4	65.8	-67.1	0	0	0	114.7	D68 P103 V104 G137 F138 M213 F225 V226	D68-H70 PolarHBondContact O-N 3.42Å; D68-H70 IonicContact OD2-CE1 2.7Å; D68-H70 PolarHBondContact OD2-CE1 3.19Å; D68-H70 VanDerWaalsContact OD2-CE1 3.31Å; D68-H70 IonicContact OD2-ND1 3.45Å; H70-P103 WeakPolarHBondContact CE1-CB 2.99Å; H70-V104 PolarHBondContact NE2-O 3.03Å; H70-G137 VanDerWaalsContact O-CA 3.26Å; H70-G137 WeakPolarHBondContact O-CA 3.33Å; H70-F138 PolarHBondContact CD2-O 3.22Å; H70-F138 PolarHBondContact O-N 3.13Å; H70-M213 VanDerWaalsContact O-SD 3.41Å; H70-F225 HydrophobicContact CB-CD2 4.28Å; H70-F225 HydrophobicContact CB-CE1 4.43Å; H70-F225 HydrophobicContact CB-CE2 3.32Å; H70-F225 HydrophobicContact CB-CZ 3.42Å; H70-F225 VanDerWaalsContact CB-CZ 3.42Å; H70-F225 AromaticContact CD2-CZ 3.66Å; H70-F225 AromaticContact CG-CE2 3.72Å; H70-F225 AromaticContact CG-CZ 3.33Å; H70-F225 AromaticContact ND1-CZ 3.87Å; H70-V226 HydrophobicContact CB-CG1 4.02Å; H70-V226 HydrophobicContact CB-CG2 4.02Å
71	V	98.5	Very high	96.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	114.5	-177.6	-173.5	0	0	0	0	110.1	L66 L67 D68 V104 L106 I109 I135	L66-V71 CarbonylContact C-O 3.58Å; L66-V71 WeakPolarHBondContact CA-O 3.45Å; L67-V71 HydrophobicContact CB-CB 4.12Å; L67-V71 HydrophobicContact CB-CG1 3.86Å; L67-V71 HydrophobicContact CD1-CG1 3.87Å; L67-V71 HydrophobicContact CG-CG1 4.34Å; L67-V71 PolarHBondContact N-O 3.47Å; D68-V71 HydrophobicContact CB-CB 4.14Å; D68-V71 HydrophobicContact CB-CG2 4.08Å; D68-V71 PolarHBondContact N-O 2.87Å; D68-V71 PolarHBondContact O-N 3.3Å; D68-V71 VanDerWaalsContact O-N 3.13Å; V71-V104 HydrophobicContact CG2-CG2 4.3Å; V71-L106 HydrophobicContact CB-CD1 4.05Å; V71-L106 HydrophobicContact CG1-CD1 3.59Å; V71-L106 HydrophobicContact CG2-CD1 3.67Å; V71-I109 HydrophobicContact CG1-CG2 4.43Å; V71-I135 HydrophobicContact CG1-CG2 3.73Å
72	A	98.7	Very high	97	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	156.2	174.4	0	0	0	0	0	111.6	L45 A65 L66 I135 C136 M213 W228	L45-A72 HydrophobicContact CD1-CB 4Å; A65-A72 CarbonylContact O-C 3.58Å; L66-A72 HydrophobicContact CD2-CB 4.06Å; A72-I135 CarbonylContact O-C 3.5Å; A72-I135 WeakPolarHBondContact O-CA 3.1Å; A72-C136 PolarHBondContact N-O 3.01Å; A72-C136 PolarHBondContact O-N 3.26Å; A72-M213 HydrophobicContact CB-CE 4.05Å; A72-W228 HydrophobicContact CB-CE3 4.32Å; A72-W228 HydrophobicContact CB-CH2 3.46Å; A72-W228 VanDerWaalsContact CB-CH2 3.46Å; A72-W228 HydrophobicContact CB-CZ2 4.34Å; A72-W228 HydrophobicContact CB-CZ3 3.48Å; A72-W228 VanDerWaalsContact CB-CZ3 3.48Å
73	V	98.7	Very high	97.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	136.2	174.9	68.2	0	0	0	0	111.6	I64 A65 L67 I86 T133 L134 I135	I64-V73 CarbonylContact C-O 3.57Å; I64-V73 WeakPolarHBondContact CA-O 3.26Å; A65-V73 HydrophobicContact CB-CG1 4.32Å; A65-V73 PolarHBondContact N-O 3.16Å; A65-V73 WeakPolarHBondContact O-CG1 3.44Å; A65-V73 PolarHBondContact O-N 3.06Å; L67-V73 HydrophobicContact CD1-CB 3.84Å; L67-V73 HydrophobicContact CD1-CG1 4.02Å; L67-V73 HydrophobicContact CD2-CG1 3.77Å; L67-V73 HydrophobicContact CG-CB 4.03Å; L67-V73 HydrophobicContact CG-CG1 3.72Å; V73-I86 HydrophobicContact CG1-CD1 4.14Å; V73-I86 HydrophobicContact CG1-CG1 3.86Å; V73-T133 HydrophobicContact CG2-CG2 4.07Å; V73-L134 CarbonylContact C-O 3.56Å; V73-L134 VanDerWaalsContact CA-O 3.25Å; V73-L134 WeakPolarHBondContact CA-O 3.42Å; V73-L134 WeakPolarHBondContact CG2-O 3.11Å; V73-I135 HydrophobicContact CB-CG1 4.47Å; V73-I135 HydrophobicContact CG2-CG1 3.93Å
74	A	98.5	Very high	97.5	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	152.5	161.2	0	0	0	0	0	109.8	A34 L45 V47 K63 I64 T133 L134	A34-A74 HydrophobicContact CB-CB 4.18Å; L45-A74 HydrophobicContact CB-CB 4.46Å; L45-A74 HydrophobicContact CD1-CB 3.98Å; L45-A74 HydrophobicContact CD2-CB 3.97Å; L45-A74 HydrophobicContact CG-CB 4.37Å; V47-A74 HydrophobicContact CG1-CB 3.68Å; K63-A74 WeakPolarHBondContact O-CA 3.4Å; I64-A74 HydrophobicContact CG1-CB 4.35Å; A74-T133 CarbonylContact O-C 3.54Å; A74-T133 VanDerWaalsContact O-CA 3.25Å; A74-T133 WeakPolarHBondContact O-CA 3.42Å; A74-L134 HydrophobicContact CB-CB 4.5Å; A74-L134 PolarHBondContact N-O 3.09Å; A74-L134 PolarHBondContact O-N 3.45Å
75	F	98.3	Very high	97.5	Very high	6 Å²	6	31.6 Å²	31.6	3%	0.026	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	153.7	179.6	66	-92.5	0	0	0	113.9	K63 T79 A82 I86 S132 T133	K63-F75 HydrophobicContact CB-CE1 4.15Å; K63-F75 HydrophobicContact CB-CZ 4.12Å; K63-F75 WeakPolarHBondContact CE-O 3.39Å; K63-F75 HydrophobicContact CG-CE2 4.31Å; K63-F75 HydrophobicContact CG-CZ 4.03Å; K63-F75 PolarHBondContact NZ-O 3.48Å; K63-F75 WeakPolarHBondContact O-CD1 3.32Å; K63-F75 WeakPolarHBondContact O-CE1 3.37Å; K63-F75 PolarHBondContact O-N 3.09Å; F75-T79 HydrophobicContact CE2-CG2 4.26Å; F75-T79 HydrophobicContact CZ-CG2 4.03Å; F75-A82 HydrophobicContact CB-CB 4.15Å; F75-A82 HydrophobicContact CD1-CB 3.61Å; F75-A82 HydrophobicContact CD2-CB 3.38Å; F75-A82 HydrophobicContact CE1-CB 3.76Å; F75-A82 HydrophobicContact CE2-CB 3.56Å; F75-A82 HydrophobicContact CG-CB 3.42Å; F75-A82 VanDerWaalsContact CG-CB 3.42Å; F75-A82 HydrophobicContact CZ-CB 3.76Å; F75-I86 HydrophobicContact CD1-CD1 4.24Å; F75-I86 HydrophobicContact CE1-CD1 4.26Å; F75-S132 WeakPolarHBondContact CA-O 3.46Å; F75-T133 HydrophobicContact CB-CG2 4.08Å
76	A	97.8	Very high	97.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	142.1	168.3	0	0	0	0	0	110.2	V28 V131 S132 I163 G164	V28-A76 HydrophobicContact CG1-CB 4.09Å; A76-V131 VanDerWaalsContact O-CA 3.24Å; A76-V131 WeakPolarHBondContact O-CA 3.44Å; A76-S132 PolarHBondContact N-O 3.28Å; A76-S132 PolarHBondContact O-N 3.19Å; A76-I163 HydrophobicContact CB-CB 4.34Å; A76-I163 HydrophobicContact CB-CD1 3.84Å; A76-I163 HydrophobicContact CB-CG1 3.87Å; A76-G164 VanDerWaalsContact CB-CA 3.47Å
77	G	97.1	Very high	97.5	Very high	12 Å²	12	32.7 Å²	32.7	12%	0.124	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	115.2	-146.5	-176.4	0	0	0	0	0	112.9	T79 G130	G77-T79 PolarHBondContact O-N 2.85Å; G77-G130 CarbonylContact C-O 3.52Å; G77-G130 VanDerWaalsContact CA-O 3.28Å; G77-G130 WeakPolarHBondContact CA-O 3.23Å
78	L	96.5	Very high	97.5	Very high	78 Å²	78	37.6 Å²	37.6	41%	0.408	20%	0.196	S	C	.	.			trans	-73.5	114.1	-175.2	-61	179.5	0	0	0	112.6	A27 A80 D81 A82 G130 V131	A27-L78 HydrophobicContact CB-CG 4.48Å; L78-A80 VanDerWaalsContact C-N 3.27Å; L78-A80 PolarHBondContact O-N 3.23Å; L78-D81 HydrophobicContact CB-CB 4.2Å; L78-D81 WeakPolarHBondContact O-CB 3.32Å; L78-D81 PolarHBondContact O-N 3.27Å; L78-D81 VanDerWaalsContact O-N 3.1Å; L78-A82 PolarHBondContact O-N 3.32Å; L78-G130 PolarHBondContact N-O 2.8Å; L78-V131 HydrophobicContact CB-CG1 4.42Å; L78-V131 WeakPolarHBondContact O-CG1 3.28Å
79	T	95.3	Very high	97.5	Very high	75 Å²	75	36.7 Å²	36.7	46%	0.46	19%	0.192	S	C	.	.	H	α-helix	trans	-59.1	-32.3	-178.8	-53.7	0	0	0	0	114.1	F75 G77 A82 R83	F75-T79 HydrophobicContact CE2-CG2 4.26Å; F75-T79 HydrophobicContact CZ-CG2 4.03Å; G77-T79 PolarHBondContact O-N 2.85Å; T79-A82 PolarHBondContact O-N 3.32Å; T79-R83 WeakPolarHBondContact O-CG 3.36Å; T79-R83 PolarHBondContact O-N 2.92Å; T79-R83 VanDerWaalsContact O-N 3.15Å
80	A	95.5	Very high	97.6	Very high	48 Å²	48	37 Å²	37	40%	0.397	19%	0.185	S	C	.	.	H	α-helix	trans	-64.2	-41.8	177.1	0	0	0	0	0	111.9	L78 R83 I84	L78-A80 VanDerWaalsContact C-N 3.27Å; L78-A80 PolarHBondContact O-N 3.23Å; A80-R83 PolarHBondContact O-N 3.13Å; A80-I84 PolarHBondContact O-N 3.35Å
81	D	97.1	Very high	97.7	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.011	21%	0.212	C	C	.	.	H	α-helix	trans	-65.5	-43.7	177.9	-73.1	8.2	0	0	0	111.3	L78 R83 I84 L85 R127 F129 G130 V131	L78-D81 HydrophobicContact CB-CB 4.2Å; L78-D81 WeakPolarHBondContact O-CB 3.32Å; L78-D81 PolarHBondContact O-N 3.27Å; L78-D81 VanDerWaalsContact O-N 3.1Å; D81-R83 VanDerWaalsContact C-N 3.31Å; D81-R83 PolarHBondContact O-N 3.42Å; D81-I84 PolarHBondContact O-N 2.6Å; D81-L85 PolarHBondContact O-N 3.38Å; D81-R127 VanDerWaalsContact CG-NH1 3.29Å; D81-R127 IonicContact OD1-CZ 3.78Å; D81-R127 IonicContact OD1-NH1 3.47Å; D81-R127 PolarHBondContact OD1-NH1 2.87Å; D81-R127 VanDerWaalsContact OD1-NH1 3.14Å; D81-R127 IonicContact OD1-NH2 2.73Å; D81-R127 PolarHBondContact OD1-NH2 3.39Å; D81-R127 IonicContact OD2-CZ 3.52Å; D81-R127 IonicContact OD2-NH1 3.48Å; D81-R127 PolarHBondContact OD2-NH1 2.88Å; D81-R127 IonicContact OD2-NH2 3.48Å; D81-F129 HydrophobicContact CB-CD1 3.89Å; D81-F129 WeakPolarHBondContact OD2-CA 3.42Å; D81-G130 PolarHBondContact OD2-N 2.7Å; D81-V131 HydrophobicContact CB-CG1 3.77Å; D81-V131 HydrophobicContact CB-CG2 4.18Å
82	A	97.6	Very high	97.7	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.008	22%	0.219	C	C	.	.	H	α-helix	trans	-57.7	-43.4	176.6	0	0	0	0	0	111.8	F75 L78 T79 I84 L85 I86 V131	F75-A82 HydrophobicContact CB-CB 4.15Å; F75-A82 HydrophobicContact CD1-CB 3.61Å; F75-A82 HydrophobicContact CD2-CB 3.38Å; F75-A82 HydrophobicContact CE1-CB 3.76Å; F75-A82 HydrophobicContact CE2-CB 3.56Å; F75-A82 HydrophobicContact CG-CB 3.42Å; F75-A82 VanDerWaalsContact CG-CB 3.42Å; F75-A82 HydrophobicContact CZ-CB 3.76Å; L78-A82 PolarHBondContact O-N 3.32Å; T79-A82 PolarHBondContact O-N 3.32Å; A82-I84 VanDerWaalsContact C-N 3.33Å; A82-I84 PolarHBondContact O-N 3.4Å; A82-L85 PolarHBondContact O-N 2.93Å; A82-I86 WeakPolarHBondContact O-CB 3.47Å; A82-I86 WeakPolarHBondContact O-CD1 3.33Å; A82-I86 WeakPolarHBondContact O-CG1 3.48Å; A82-I86 PolarHBondContact O-N 3.34Å; A82-V131 HydrophobicContact CB-CG1 4.23Å
83	R	96.9	Very high	97.6	Very high	169 Å²	169	42.9 Å²	42.9	64%	0.638	22%	0.219	S	C	*	.	H	α-helix	trans	-61.6	-39.7	177.5	-73	-173.7	-66.4	167.2	-0.1	112.7	T79 A80 D81 S87	T79-R83 WeakPolarHBondContact O-CG 3.36Å; T79-R83 PolarHBondContact O-N 2.92Å; T79-R83 VanDerWaalsContact O-N 3.15Å; A80-R83 PolarHBondContact O-N 3.13Å; D81-R83 VanDerWaalsContact C-N 3.31Å; D81-R83 PolarHBondContact O-N 3.42Å; R83-S87 WeakPolarHBondContact O-CB 2.96Å; R83-S87 PolarHBondContact O-N 3.03Å
84	I	97	Very high	97.6	Very high	75 Å²	75	49.5 Å²	49.5	39%	0.385	25%	0.248	S	C	.	.	H	α-helix	trans	-64.7	-46.4	177.1	-65.3	167.9	0	0	0	110.3	A80 D81 A82 S87 R88 F129	A80-I84 PolarHBondContact O-N 3.35Å; D81-I84 PolarHBondContact O-N 2.6Å; A82-I84 VanDerWaalsContact C-N 3.33Å; A82-I84 PolarHBondContact O-N 3.4Å; I84-S87 PolarHBondContact O-N 3.03Å; I84-R88 WeakPolarHBondContact O-CG 3.46Å; I84-R88 PolarHBondContact O-N 3.02Å; I84-R88 VanDerWaalsContact O-N 3.12Å; I84-F129 HydrophobicContact CB-CE1 4.39Å; I84-F129 HydrophobicContact CG2-CE1 4.08Å; I84-F129 HydrophobicContact CG2-CZ 4.42Å
85	L	98	Very high	97.5	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-62.3	-52.9	177.8	-69.3	176.3	0	0	0	111	D81 A82 S87 R88 I89 L116 K117 F129 V131	D81-L85 PolarHBondContact O-N 3.38Å; A82-L85 PolarHBondContact O-N 2.93Å; L85-S87 VanDerWaalsContact C-N 3.26Å; L85-S87 PolarHBondContact O-N 3.22Å; L85-R88 PolarHBondContact O-N 3.48Å; L85-I89 VanDerWaalsContact O-CG1 3.29Å; L85-I89 WeakPolarHBondContact O-CG1 3.5Å; L85-I89 PolarHBondContact O-N 3.37Å; L85-L116 HydrophobicContact CD2-CD2 3.64Å; L85-L116 HydrophobicContact CD2-CG 4.16Å; L85-K117 VanDerWaalsContact CD1-CE 3.46Å; L85-K117 HydrophobicContact CD1-CG 4.36Å; L85-K117 HydrophobicContact CD2-CG 4.42Å; L85-F129 HydrophobicContact CD1-CB 4.35Å; L85-F129 HydrophobicContact CD1-CD1 4.23Å; L85-F129 HydrophobicContact CD1-CG 4.19Å; L85-F129 HydrophobicContact CD2-CD1 4.14Å; L85-F129 HydrophobicContact CD2-CD2 3.99Å; L85-F129 HydrophobicContact CD2-CE1 3.9Å; L85-F129 HydrophobicContact CD2-CE2 3.73Å; L85-F129 HydrophobicContact CD2-CG 4.17Å; L85-F129 HydrophobicContact CD2-CZ 3.68Å; L85-F129 HydrophobicContact CG-CD1 3.99Å; L85-F129 HydrophobicContact CG-CE1 4Å; L85-F129 HydrophobicContact CG-CG 4.28Å; L85-F129 HydrophobicContact CG-CZ 4.31Å; L85-V131 HydrophobicContact CD1-CG2 3.4Å
86	I	98.3	Very high	97.5	Very high	17 Å²	17	54.9 Å²	54.9	9%	0.087	28%	0.277	C	S	.	.	H	α-helix	trans	-52.6	-45.9	178.8	-71.9	163.7	0	0	0	111.1	A65 L67 V73 F75 A82 R88 I89 R90	A65-I86 HydrophobicContact CB-CD1 4.06Å; A65-I86 HydrophobicContact CB-CG2 4.44Å; L67-I86 HydrophobicContact CD2-CB 4.23Å; L67-I86 HydrophobicContact CD2-CG1 4.13Å; L67-I86 HydrophobicContact CD2-CG2 4.06Å; V73-I86 HydrophobicContact CG1-CD1 4.14Å; V73-I86 HydrophobicContact CG1-CG1 3.86Å; F75-I86 HydrophobicContact CD1-CD1 4.24Å; F75-I86 HydrophobicContact CE1-CD1 4.26Å; A82-I86 WeakPolarHBondContact O-CB 3.47Å; A82-I86 WeakPolarHBondContact O-CD1 3.33Å; A82-I86 WeakPolarHBondContact O-CG1 3.48Å; A82-I86 PolarHBondContact O-N 3.34Å; I86-R88 PolarHBondContact O-N 3.03Å; I86-I89 PolarHBondContact O-N 3.44Å; I86-R90 WeakPolarHBondContact O-CB 3.45Å; I86-R90 VanDerWaalsContact O-CG 3.3Å; I86-R90 WeakPolarHBondContact O-CG 3.48Å; I86-R90 PolarHBondContact O-N 3.14Å
87	S	98.2	Very high	97.4	Very high	72 Å²	72	59.3 Å²	59.3	50%	0.503	30%	0.296	S	S	.	.	H	α-helix	trans	-62.8	-41.6	178.9	-171.1	0	0	0	0	112.6	R83 I84 L85 V91	R83-S87 WeakPolarHBondContact O-CB 2.96Å; R83-S87 PolarHBondContact O-N 3.03Å; I84-S87 PolarHBondContact O-N 3.03Å; L85-S87 VanDerWaalsContact C-N 3.26Å; L85-S87 PolarHBondContact O-N 3.22Å; S87-V91 WeakPolarHBondContact O-CG2 3.41Å; S87-V91 PolarHBondContact O-N 3.39Å
88	R	98	Very high	97.3	Very high	109 Å²	109	65.7 Å²	65.7	41%	0.411	33%	0.327	S	S	.	.	H	α-helix	trans	-68.7	-42.7	178.8	-73.1	175.2	179.9	-122.1	-2.7	111.7	I84 L85 I86 V91 E92 L116 Y120	I84-R88 WeakPolarHBondContact O-CG 3.46Å; I84-R88 PolarHBondContact O-N 3.02Å; I84-R88 VanDerWaalsContact O-N 3.12Å; L85-R88 PolarHBondContact O-N 3.48Å; I86-R88 PolarHBondContact O-N 3.03Å; R88-V91 WeakPolarHBondContact O-CB 3.27Å; R88-V91 PolarHBondContact O-N 3.46Å; R88-E92 PolarHBondContact O-N 2.81Å; R88-L116 HydrophobicContact CB-CD2 4.13Å; R88-Y120 PolarHBondContact NH1-OH 2.89Å; R88-Y120 PolarHBondContact NH2-OH 3.48Å; R88-Y120 VanDerWaalsContact NH2-OH 3.14Å
89	I	98.5	Very high	97.3	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-67.4	-38.2	-179.7	-60.5	-52.9	0	0	0	111.6	L67 L85 I86 V91 E92 C93 I109 Y112 M113	L67-I89 HydrophobicContact CB-CG2 4.25Å; L67-I89 HydrophobicContact CD1-CG2 3.77Å; L67-I89 HydrophobicContact CD2-CB 4.01Å; L67-I89 HydrophobicContact CD2-CG2 3.96Å; L67-I89 HydrophobicContact CG-CG2 4.21Å; L85-I89 VanDerWaalsContact O-CG1 3.29Å; L85-I89 WeakPolarHBondContact O-CG1 3.5Å; L85-I89 PolarHBondContact O-N 3.37Å; I86-I89 PolarHBondContact O-N 3.44Å; I89-V91 VanDerWaalsContact C-N 3.26Å; I89-V91 PolarHBondContact O-N 3.39Å; I89-E92 WeakPolarHBondContact O-CA 3.32Å; I89-E92 WeakPolarHBondContact O-CB 3.29Å; I89-E92 PolarHBondContact O-N 3.35Å; I89-E92 VanDerWaalsContact O-N 3.07Å; I89-C93 PolarHBondContact O-N 3.4Å; I89-C93 PolarHBondContact O-SG 2.91Å; I89-I109 HydrophobicContact CG2-CD1 4.21Å; I89-I109 HydrophobicContact CG2-CG2 3.54Å; I89-Y112 HydrophobicContact CD1-CD1 3.4Å; I89-Y112 HydrophobicContact CD1-CE1 3.75Å; I89-M113 HydrophobicContact CD1-CB 3.85Å; I89-M113 HydrophobicContact CD1-CE 4.5Å; I89-M113 HydrophobicContact CD1-CG 4.22Å; I89-M113 HydrophobicContact CG1-CB 4.29Å; I89-M113 HydrophobicContact CG1-CE 3.69Å; I89-M113 HydrophobicContact CG1-CG 4.27Å
90	R	98.6	Very high	97.3	Very high	108 Å²	108	67 Å²	67	41%	0.408	34%	0.337	S	S	.	.	H	α-helix	trans	-58.2	-38.2	172.7	-78.8	171.5	173.9	177	-1.9	113.2	L66 L67 I86 K94	L66-R90 PolarHBondContact O-NE 3.01Å; L66-R90 PolarHBondContact O-NH2 2.93Å; L67-R90 WeakPolarHBondContact O-CG 3.34Å; I86-R90 WeakPolarHBondContact O-CB 3.45Å; I86-R90 VanDerWaalsContact O-CG 3.3Å; I86-R90 WeakPolarHBondContact O-CG 3.48Å; I86-R90 PolarHBondContact O-N 3.14Å; R90-K94 WeakPolarHBondContact O-CG 3.42Å; R90-K94 PolarHBondContact O-N 3.41Å
91	V	98.4	Very high	97.1	Very high	96 Å²	96	72.8 Å²	72.8	58%	0.582	36%	0.357	S	S	*	.	H	α-helix	trans	-66.8	-42.9	175.2	173.4	0	0	0	0	109.8	S87 R88 I89 K94 S95	S87-V91 WeakPolarHBondContact O-CG2 3.41Å; S87-V91 PolarHBondContact O-N 3.39Å; R88-V91 WeakPolarHBondContact O-CB 3.27Å; R88-V91 PolarHBondContact O-N 3.46Å; I89-V91 VanDerWaalsContact C-N 3.26Å; I89-V91 PolarHBondContact O-N 3.39Å; V91-K94 PolarHBondContact O-N 2.87Å; V91-S95 VanDerWaalsContact O-CB 3.29Å; V91-S95 WeakPolarHBondContact O-CB 3.42Å; V91-S95 PolarHBondContact O-N 2.85Å
92	E	98.2	Very high	96.9	Very high	32 Å²	32	76.5 Å²	76.5	15%	0.15	38%	0.376	C	S	.	.	H	α-helix	trans	-61	-48.8	176.9	-170.6	60.7	-145.1	0	0	112.5	R88 I89 K94 S95 Y96 Y108 Y112	R88-E92 PolarHBondContact O-N 2.81Å; I89-E92 WeakPolarHBondContact O-CA 3.32Å; I89-E92 WeakPolarHBondContact O-CB 3.29Å; I89-E92 PolarHBondContact O-N 3.35Å; I89-E92 VanDerWaalsContact O-N 3.07Å; E92-K94 VanDerWaalsContact C-N 3.28Å; E92-K94 PolarHBondContact O-N 3.19Å; E92-S95 PolarHBondContact O-N 2.85Å; E92-Y96 WeakPolarHBondContact O-CB 3.23Å; E92-Y96 PolarHBondContact O-N 3.11Å; E92-Y108 HydrophobicContact CG-CE1 4.15Å; E92-Y108 PolarHBondContact OE1-OH 2.96Å; E92-Y112 HydrophobicContact CB-CD1 4.38Å; E92-Y112 HydrophobicContact CB-CE1 3.97Å; E92-Y112 HydrophobicContact CB-CE2 4.46Å; E92-Y112 VanDerWaalsContact CD-CZ 3.47Å; E92-Y112 HydrophobicContact CG-CD1 4.03Å; E92-Y112 HydrophobicContact CG-CD2 3.8Å; E92-Y112 HydrophobicContact CG-CE1 3.86Å; E92-Y112 HydrophobicContact CG-CE2 3.59Å; E92-Y112 HydrophobicContact CG-CG 3.99Å; E92-Y112 WeakPolarHBondContact OE2-CE2 3.16Å; E92-Y112 PolarHBondContact OE2-OH 3.29Å
93	C	97.9	Very high	96.7	Very high	0 Å²	0	77.2 Å²	77.2	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-53.8	-47.1	178	-60.6	0	0	0	0	111.5	D68 I89 K97 V104 I109	D68-C93 HydrophobicContact CB-CB 3.98Å; I89-C93 PolarHBondContact O-N 3.4Å; I89-C93 PolarHBondContact O-SG 2.91Å; C93-K97 WeakPolarHBondContact O-CB 3.29Å; C93-K97 PolarHBondContact O-N 2.9Å; C93-K97 VanDerWaalsContact O-N 3.09Å; C93-V104 HydrophobicContact CB-CG2 4.13Å; C93-I109 WeakPolarHBondContact SG-CD1 3.37Å
94	K	97.3	Very high	96.8	Very high	139 Å²	139	69.3 Å²	69.3	60%	0.604	35%	0.351	S	S	*	.	H	α-helix	trans	-68.6	-42.6	179.1	-69.3	-177.9	179.3	-170.3	0	112.5	R90 V91 E92 Y96 K97 L98	R90-K94 WeakPolarHBondContact O-CG 3.42Å; R90-K94 PolarHBondContact O-N 3.41Å; V91-K94 PolarHBondContact O-N 2.87Å; E92-K94 VanDerWaalsContact C-N 3.28Å; E92-K94 PolarHBondContact O-N 3.19Å; K94-Y96 VanDerWaalsContact C-N 3.32Å; K94-Y96 PolarHBondContact O-N 3.41Å; K94-K97 PolarHBondContact O-N 3.38Å; K94-L98 WeakPolarHBondContact O-CG 3.3Å; K94-L98 PolarHBondContact O-N 3.07Å
95	S	98	Very high	96.8	Very high	55 Å²	55	67.8 Å²	67.8	39%	0.385	35%	0.347	S	S	.	.	H	α-helix	trans	-61.7	-43.4	179	-170.7	0	0	0	0	111.2	V91 E92 L98 T99	V91-S95 VanDerWaalsContact O-CB 3.29Å; V91-S95 WeakPolarHBondContact O-CB 3.42Å; V91-S95 PolarHBondContact O-N 2.85Å; E92-S95 PolarHBondContact O-N 2.85Å; S95-L98 PolarHBondContact O-N 2.87Å; S95-T99 PolarHBondContact O-N 3.5Å; S95-T99 PolarHBondContact O-OG1 3.26Å
96	Y	97.8	Very high	96.8	Very high	63 Å²	63	67.7 Å²	67.7	25%	0.247	35%	0.347	C	S	.	.	H	α-helix	trans	-60.7	-50.8	175.7	-174.9	-82.3	0	0	0	110.9	E92 K94 L98 T99 V100 D102 V104 Y108	E92-Y96 WeakPolarHBondContact O-CB 3.23Å; E92-Y96 PolarHBondContact O-N 3.11Å; K94-Y96 VanDerWaalsContact C-N 3.32Å; K94-Y96 PolarHBondContact O-N 3.41Å; Y96-L98 VanDerWaalsContact C-N 3.27Å; Y96-L98 PolarHBondContact O-N 2.8Å; Y96-T99 PolarHBondContact O-N 3.46Å; Y96-V100 HydrophobicContact CD1-CB 4.19Å; Y96-V100 HydrophobicContact CD1-CG2 4.15Å; Y96-V100 HydrophobicContact CD2-CG2 4.26Å; Y96-V100 HydrophobicContact CE1-CB 3.83Å; Y96-V100 HydrophobicContact CE1-CG1 4.06Å; Y96-V100 HydrophobicContact CE1-CG2 3.87Å; Y96-V100 HydrophobicContact CE2-CG2 3.98Å; Y96-V100 HydrophobicContact CG-CG2 4.34Å; Y96-V100 PolarHBondContact O-N 2.74Å; Y96-D102 WeakPolarHBondContact CD1-O 3.33Å; Y96-V104 VanDerWaalsContact CB-CG1 3.43Å; Y96-V104 HydrophobicContact CD1-CB 4.34Å; Y96-V104 HydrophobicContact CD1-CG1 3.4Å; Y96-V104 HydrophobicContact CD2-CG1 4.06Å; Y96-V104 HydrophobicContact CE1-CG1 4.14Å; Y96-V104 HydrophobicContact CG-CG1 3.35Å; Y96-Y108 HydrophobicContact CD2-CD1 4.36Å; Y96-Y108 AromaticContact CD2-CE1 3.8Å; Y96-Y108 HydrophobicContact CD2-CE1 3.8Å; Y96-Y108 HydrophobicContact CD2-CE2 4.24Å; Y96-Y108 AromaticContact CD2-CZ 3.73Å; Y96-Y108 HydrophobicContact CE2-CD2 4.37Å; Y96-Y108 HydrophobicContact CE2-CE1 4.3Å; Y96-Y108 HydrophobicContact CE2-CE2 4.12Å; Y96-Y108 HydrophobicContact CG-CE1 4.44Å
97	K	94.4	Very high	96.8	Very high	93 Å²	93	71.2 Å²	71.2	40%	0.404	36%	0.363	S	S	.	.	H	α-helix	trans	-59.6	-34.5	178.5	-171.6	175.1	-177.8	174	0	113.3	C93 K94 T99 E101 D102	C93-K97 WeakPolarHBondContact O-CB 3.29Å; C93-K97 PolarHBondContact O-N 2.9Å; C93-K97 VanDerWaalsContact O-N 3.09Å; K94-K97 PolarHBondContact O-N 3.38Å; K97-T99 VanDerWaalsContact C-N 3.3Å; K97-E101 WeakPolarHBondContact O-CA 3.2Å; K97-E101 PolarHBondContact O-N 3.49Å; K97-D102 WeakPolarHBondContact CA-O 3.3Å
98	L	95.9	Very high	96.8	Very high	147 Å²	147	70.2 Å²	70.2	77%	0.77	35%	0.349	S	S	*	.	H	α-helix	trans	-71.3	-24.7	174.5	-73	171.9	0	0	0	113.5	K94 S95 Y96	K94-L98 WeakPolarHBondContact O-CG 3.3Å; K94-L98 PolarHBondContact O-N 3.07Å; S95-L98 PolarHBondContact O-N 2.87Å; Y96-L98 VanDerWaalsContact C-N 3.27Å; Y96-L98 PolarHBondContact O-N 2.8Å
99	T	97	Very high	96.8	Very high	113 Å²	113	65 Å²	65	69%	0.693	33%	0.329	S	S	*	.	H	α-helix	trans	-94.1	-40.9	-175.7	-54.7	0	0	0	0	111.9	S95 Y96 K97	S95-T99 PolarHBondContact O-N 3.5Å; S95-T99 PolarHBondContact O-OG1 3.26Å; Y96-T99 PolarHBondContact O-N 3.46Å; K97-T99 VanDerWaalsContact C-N 3.3Å
100	V	93.8	Very high	96.8	Very high	66 Å²	66	65 Å²	65	40%	0.4	33%	0.329	S	S	.	.	H	α-helix	trans	-101	-12.4	-173.9	-172.7	0	0	0	0	111.4	Y96 D102	Y96-V100 HydrophobicContact CD1-CB 4.19Å; Y96-V100 HydrophobicContact CD1-CG2 4.15Å; Y96-V100 HydrophobicContact CD2-CG2 4.26Å; Y96-V100 HydrophobicContact CE1-CB 3.83Å; Y96-V100 HydrophobicContact CE1-CG1 4.06Å; Y96-V100 HydrophobicContact CE1-CG2 3.87Å; Y96-V100 HydrophobicContact CE2-CG2 3.98Å; Y96-V100 HydrophobicContact CG-CG2 4.34Å; Y96-V100 PolarHBondContact O-N 2.74Å; V100-D102 HydrophobicContact CG1-CB 4.26Å; V100-D102 PolarHBondContact O-N 3.12Å
101	E	92	Very high	96.8	Very high	171 Å²	171	64.7 Å²	64.7	80%	0.799	33%	0.328	S	S	*	.	S	Bend	trans	62.7	-6.6	-172.6	-57.8	-172.4	155.5	0	0	114.9	K97	K97-E101 WeakPolarHBondContact O-CA 3.2Å; K97-E101 PolarHBondContact O-N 3.49Å
102	D	92.9	Very high	96.8	Very high	79 Å²	79	63.4 Å²	63.4	42%	0.422	31%	0.313	S	S	.	.	S	Bend	trans	-102.3	148.9	171.7	-78.8	-39	0	0	0	112.7	Y96 K97 V100 Q140	Y96-D102 WeakPolarHBondContact CD1-O 3.33Å; K97-D102 WeakPolarHBondContact CA-O 3.3Å; V100-D102 HydrophobicContact CG1-CB 4.26Å; V100-D102 PolarHBondContact O-N 3.12Å; D102-Q140 PolarHBondContact OD1-NE2 3.1Å
103	P	94.3	Very high	96.8	Very high	17 Å²	17	61.9 Å²	61.9	11%	0.11	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-62.3	152.6	168.5	31.3	-36.8	0	0	0	111.5	H70 Q140 F225	H70-P103 WeakPolarHBondContact CE1-CB 2.99Å; P103-Q140 HydrophobicContact CG-CG 3.36Å; P103-Q140 VanDerWaalsContact CG-NE2 3.34Å; P103-F225 HydrophobicContact CB-CE1 4.44Å; P103-F225 HydrophobicContact CB-CZ 4.47Å; P103-F225 HydrophobicContact CG-CE1 3.95Å; P103-F225 HydrophobicContact CG-CZ 4.18Å
104	V	97.4	Very high	96.9	Very high	2 Å²	2	62 Å²	62	1%	0.012	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-65	145.9	175.8	-71.3	0	0	0	0	112.6	H70 V71 C93 Y96 Y108 I109	H70-V104 PolarHBondContact NE2-O 3.03Å; V71-V104 HydrophobicContact CG2-CG2 4.3Å; C93-V104 HydrophobicContact CB-CG2 4.13Å; Y96-V104 VanDerWaalsContact CB-CG1 3.43Å; Y96-V104 HydrophobicContact CD1-CB 4.34Å; Y96-V104 HydrophobicContact CD1-CG1 3.4Å; Y96-V104 HydrophobicContact CD2-CG1 4.06Å; Y96-V104 HydrophobicContact CE1-CG1 4.14Å; Y96-V104 HydrophobicContact CG-CG1 3.35Å; V104-Y108 HydrophobicContact CB-CD1 4.12Å; V104-Y108 HydrophobicContact CG1-CD1 3.85Å; V104-Y108 HydrophobicContact CG1-CE1 4.04Å; V104-I109 HydrophobicContact CB-CD1 3.98Å; V104-I109 HydrophobicContact CB-CG1 3.73Å; V104-I109 HydrophobicContact CG1-CD1 3.95Å; V104-I109 HydrophobicContact CG1-CG1 4.28Å; V104-I109 HydrophobicContact CG2-CD1 3.85Å; V104-I109 HydrophobicContact CG2-CG1 3.45Å; V104-I109 VanDerWaalsContact CG2-CG1 3.45Å
105	S	97.8	Very high	96.9	Very high	43 Å²	43	60.8 Å²	60.8	30%	0.301	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-76	154.4	165.5	74.2	0	0	0	0	111.8	E107 Y108 I109 N139	S105-E107 VanDerWaalsContact C-N 3.31Å; S105-E107 PolarHBondContact O-N 3.5Å; S105-Y108 PolarHBondContact O-N 3.48Å; S105-Y108 VanDerWaalsContact OG-CB 3.27Å; S105-Y108 WeakPolarHBondContact OG-CB 3.18Å; S105-Y108 PolarHBondContact OG-N 2.83Å; S105-Y108 VanDerWaalsContact OG-N 3.15Å; S105-I109 PolarHBondContact O-N 3.1Å; S105-N139 VanDerWaalsContact CA-OD1 3.29Å; S105-N139 WeakPolarHBondContact CA-OD1 3.45Å; S105-N139 WeakPolarHBondContact CB-OD1 3.31Å
106	L	98.4	Very high	96.9	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62.8	-39.4	176.6	-79.5	-47.2	0	0	0	112	V71 Y108 I109 A110 I135 F138 N139 H145 Y147	V71-L106 HydrophobicContact CB-CD1 4.05Å; V71-L106 HydrophobicContact CG1-CD1 3.59Å; V71-L106 HydrophobicContact CG2-CD1 3.67Å; L106-Y108 VanDerWaalsContact C-N 3.34Å; L106-Y108 PolarHBondContact O-N 2.95Å; L106-I109 PolarHBondContact O-N 3.05Å; L106-A110 WeakPolarHBondContact O-CB 3.24Å; L106-A110 PolarHBondContact O-N 3.28Å; L106-I135 HydrophobicContact CD1-CG2 4.15Å; L106-F138 WeakPolarHBondContact CD2-O 3.33Å; L106-N139 WeakPolarHBondContact CD2-OD1 3.26Å; L106-N139 PolarHBondContact N-OD1 3.37Å; L106-H145 HydrophobicContact CB-CB 3.84Å; L106-H145 HydrophobicContact CG-CB 4.01Å; L106-Y147 HydrophobicContact CB-CD2 3.95Å; L106-Y147 HydrophobicContact CB-CE2 3.75Å
107	E	98.2	Very high	96.9	Very high	91 Å²	91	56.2 Å²	56.2	43%	0.425	28%	0.278	S	S	.	.	H	α-helix	trans	-60.5	-45	175.8	-168.8	-162	156.8	0	0	111	S105 I109 A110 R111 Y147	S105-E107 VanDerWaalsContact C-N 3.31Å; S105-E107 PolarHBondContact O-N 3.5Å; E107-I109 PolarHBondContact O-N 3.46Å; E107-A110 PolarHBondContact O-N 3.04Å; E107-R111 VanDerWaalsContact O-CB 3.3Å; E107-R111 WeakPolarHBondContact O-CB 3.48Å; E107-R111 PolarHBondContact O-N 3.4Å; E107-Y147 HydrophobicContact CB-CE2 4.3Å; E107-Y147 HydrophobicContact CG-CE1 4.43Å
108	Y	98.2	Very high	97	Very high	50 Å²	50	55.3 Å²	55.3	20%	0.196	28%	0.276	C	S	.	.	H	α-helix	trans	-58	-48.8	179	174.4	-92.8	0	0	0	111.3	E92 Y96 V104 S105 L106 R111 Y112	E92-Y108 HydrophobicContact CG-CE1 4.15Å; E92-Y108 PolarHBondContact OE1-OH 2.96Å; Y96-Y108 HydrophobicContact CD2-CD1 4.36Å; Y96-Y108 AromaticContact CD2-CE1 3.8Å; Y96-Y108 HydrophobicContact CD2-CE1 3.8Å; Y96-Y108 HydrophobicContact CD2-CE2 4.24Å; Y96-Y108 AromaticContact CD2-CZ 3.73Å; Y96-Y108 HydrophobicContact CE2-CD2 4.37Å; Y96-Y108 HydrophobicContact CE2-CE1 4.3Å; Y96-Y108 HydrophobicContact CE2-CE2 4.12Å; Y96-Y108 HydrophobicContact CG-CE1 4.44Å; V104-Y108 HydrophobicContact CB-CD1 4.12Å; V104-Y108 HydrophobicContact CG1-CD1 3.85Å; V104-Y108 HydrophobicContact CG1-CE1 4.04Å; S105-Y108 PolarHBondContact O-N 3.48Å; S105-Y108 VanDerWaalsContact OG-CB 3.27Å; S105-Y108 WeakPolarHBondContact OG-CB 3.18Å; S105-Y108 PolarHBondContact OG-N 2.83Å; S105-Y108 VanDerWaalsContact OG-N 3.15Å; L106-Y108 VanDerWaalsContact C-N 3.34Å; L106-Y108 PolarHBondContact O-N 2.95Å; Y108-R111 PolarHBondContact O-N 3.07Å; Y108-Y112 WeakPolarHBondContact O-CB 3.32Å; Y108-Y112 PolarHBondContact O-N 2.91Å
109	I	98.4	Very high	96.9	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-67.6	-39.6	180	-69	-57.2	0	0	0	112.3	L67 V71 I89 C93 V104 S105 L106 E107 Y112 M113 I135	L67-I109 HydrophobicContact CD1-CG2 4.08Å; V71-I109 HydrophobicContact CG1-CG2 4.43Å; I89-I109 HydrophobicContact CG2-CD1 4.21Å; I89-I109 HydrophobicContact CG2-CG2 3.54Å; C93-I109 WeakPolarHBondContact SG-CD1 3.37Å; V104-I109 HydrophobicContact CB-CD1 3.98Å; V104-I109 HydrophobicContact CB-CG1 3.73Å; V104-I109 HydrophobicContact CG1-CD1 3.95Å; V104-I109 HydrophobicContact CG1-CG1 4.28Å; V104-I109 HydrophobicContact CG2-CD1 3.85Å; V104-I109 HydrophobicContact CG2-CG1 3.45Å; V104-I109 VanDerWaalsContact CG2-CG1 3.45Å; S105-I109 PolarHBondContact O-N 3.1Å; L106-I109 PolarHBondContact O-N 3.05Å; E107-I109 PolarHBondContact O-N 3.46Å; I109-Y112 PolarHBondContact O-N 3.37Å; I109-M113 WeakPolarHBondContact O-CB 3.39Å; I109-M113 PolarHBondContact O-N 2.75Å; I109-I135 HydrophobicContact CG2-CD1 4.43Å; I109-I135 HydrophobicContact CG2-CG2 4.46Å
110	A	98.5	Very high	96.8	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.7	-47.5	175.2	0	0	0	0	0	111.2	L106 E107 M113 A114 I135 Y147 T149 H155	L106-A110 WeakPolarHBondContact O-CB 3.24Å; L106-A110 PolarHBondContact O-N 3.28Å; E107-A110 PolarHBondContact O-N 3.04Å; A110-M113 PolarHBondContact O-N 2.89Å; A110-A114 VanDerWaalsContact O-CB 3.3Å; A110-A114 WeakPolarHBondContact O-CB 3.43Å; A110-A114 PolarHBondContact O-N 3.33Å; A110-I135 HydrophobicContact CB-CD1 4.26Å; A110-Y147 HydrophobicContact CB-CD1 3.93Å; A110-Y147 HydrophobicContact CB-CD2 4.05Å; A110-Y147 HydrophobicContact CB-CG 3.56Å; A110-T149 HydrophobicContact CB-CG2 4.34Å; A110-T149 WeakPolarHBondContact O-CG2 3.47Å; A110-H155 HydrophobicContact CB-CB 4.45Å
111	R	98.5	Very high	96.8	Very high	102 Å²	102	47 Å²	47	39%	0.385	22%	0.219	S	C	.	.	H	α-helix	trans	-63.2	-44.7	176.9	-179.2	173.7	59.5	-174.9	-5.6	112.1	E107 Y108 A114 Q115	E107-R111 VanDerWaalsContact O-CB 3.3Å; E107-R111 WeakPolarHBondContact O-CB 3.48Å; E107-R111 PolarHBondContact O-N 3.4Å; Y108-R111 PolarHBondContact O-N 3.07Å; R111-A114 PolarHBondContact O-N 3.36Å; R111-Q115 WeakPolarHBondContact O-CB 3.45Å; R111-Q115 WeakPolarHBondContact O-CG 3.49Å; R111-Q115 PolarHBondContact O-N 3.32Å
112	Y	98.5	Very high	96.6	Very high	68 Å²	68	44.3 Å²	44.3	27%	0.267	21%	0.206	S	C	.	.	H	α-helix	trans	-62.1	-45.1	178.2	-176.5	-80.9	0	0	0	111.4	I89 E92 Y108 I109 A114 Q115 L116	I89-Y112 HydrophobicContact CD1-CD1 3.4Å; I89-Y112 HydrophobicContact CD1-CE1 3.75Å; E92-Y112 HydrophobicContact CB-CD1 4.38Å; E92-Y112 HydrophobicContact CB-CE1 3.97Å; E92-Y112 HydrophobicContact CB-CE2 4.46Å; E92-Y112 VanDerWaalsContact CD-CZ 3.47Å; E92-Y112 HydrophobicContact CG-CD1 4.03Å; E92-Y112 HydrophobicContact CG-CD2 3.8Å; E92-Y112 HydrophobicContact CG-CE1 3.86Å; E92-Y112 HydrophobicContact CG-CE2 3.59Å; E92-Y112 HydrophobicContact CG-CG 3.99Å; E92-Y112 WeakPolarHBondContact OE2-CE2 3.16Å; E92-Y112 PolarHBondContact OE2-OH 3.29Å; Y108-Y112 WeakPolarHBondContact O-CB 3.32Å; Y108-Y112 PolarHBondContact O-N 2.91Å; I109-Y112 PolarHBondContact O-N 3.37Å; Y112-A114 VanDerWaalsContact C-N 3.32Å; Y112-A114 PolarHBondContact O-N 2.89Å; Y112-Q115 PolarHBondContact O-N 3.09Å; Y112-L116 WeakPolarHBondContact O-CB 3.26Å; Y112-L116 PolarHBondContact O-N 3.11Å
113	M	98.6	Very high	96.4	Very high	1 Å²	1	42 Å²	42	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-62.6	-40.8	176.2	-170.5	-173.1	-67	0	0	111.4	L67 I89 I109 A110 L116 K117 T133 I135 T149	L67-M113 HydrophobicContact CD1-CE 4.14Å; I89-M113 HydrophobicContact CD1-CB 3.85Å; I89-M113 HydrophobicContact CD1-CE 4.5Å; I89-M113 HydrophobicContact CD1-CG 4.22Å; I89-M113 HydrophobicContact CG1-CB 4.29Å; I89-M113 HydrophobicContact CG1-CE 3.69Å; I89-M113 HydrophobicContact CG1-CG 4.27Å; I109-M113 WeakPolarHBondContact O-CB 3.39Å; I109-M113 PolarHBondContact O-N 2.75Å; A110-M113 PolarHBondContact O-N 2.89Å; M113-L116 PolarHBondContact O-N 3.34Å; M113-K117 WeakPolarHBondContact O-CG 3.44Å; M113-K117 PolarHBondContact O-N 3.23Å; M113-T133 HydrophobicContact CE-CG2 4.47Å; M113-T133 HydrophobicContact SD-CG2 3.74Å; M113-T133 PolarHBondContact SD-OG1 2.88Å; M113-I135 HydrophobicContact CB-CD1 4.43Å; M113-I135 HydrophobicContact CE-CD1 3.67Å; M113-I135 HydrophobicContact CE-CG1 4.15Å; M113-I135 HydrophobicContact SD-CD1 3.92Å; M113-T149 HydrophobicContact CB-CG2 4.42Å; M113-T149 HydrophobicContact SD-CG2 4.42Å; M113-T149 PolarHBondContact SD-OG1 2.8Å
114	A	98.4	Very high	95.9	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.008	22%	0.223	C	C	.	.	H	α-helix	trans	-64	-44.8	177	0	0	0	0	0	112	A110 R111 Y112 L116 K117 Q118 G153 H155	A110-A114 VanDerWaalsContact O-CB 3.3Å; A110-A114 WeakPolarHBondContact O-CB 3.43Å; A110-A114 PolarHBondContact O-N 3.33Å; R111-A114 PolarHBondContact O-N 3.36Å; Y112-A114 VanDerWaalsContact C-N 3.32Å; Y112-A114 PolarHBondContact O-N 2.89Å; A114-L116 VanDerWaalsContact C-N 3.33Å; A114-L116 PolarHBondContact O-N 2.9Å; A114-K117 PolarHBondContact O-N 2.97Å; A114-Q118 WeakPolarHBondContact O-CB 3.48Å; A114-Q118 PolarHBondContact O-N 3.31Å; A114-G153 WeakPolarHBondContact CB-O 3.44Å; A114-G153 WeakPolarHBondContact O-CA 3.4Å; A114-H155 HydrophobicContact CB-CB 3.96Å
115	Q	98.1	Very high	95.3	Very high	115 Å²	115	51.4 Å²	51.4	54%	0.537	27%	0.267	S	S	.	.	H	α-helix	trans	-61.1	-40.9	173.8	-73.7	174.2	-12.8	0	0	112	R111 Y112 K117 Q118 K119	R111-Q115 WeakPolarHBondContact O-CB 3.45Å; R111-Q115 WeakPolarHBondContact O-CG 3.49Å; R111-Q115 PolarHBondContact O-N 3.32Å; Y112-Q115 PolarHBondContact O-N 3.09Å; Q115-K117 VanDerWaalsContact C-N 3.34Å; Q115-K117 PolarHBondContact O-N 2.84Å; Q115-Q118 PolarHBondContact O-N 3.44Å; Q115-K119 WeakPolarHBondContact O-CB 3.49Å; Q115-K119 PolarHBondContact O-N 3.34Å
116	L	97.4	Very high	94.9	Very high	21 Å²	21	54.9 Å²	54.9	11%	0.11	27%	0.273	C	S	.	.	H	α-helix	trans	-61.8	-42.4	174.7	177.7	62.3	0	0	0	111.4	L85 R88 Y112 M113 A114 Y120 F129	L85-L116 HydrophobicContact CD2-CD2 3.64Å; L85-L116 HydrophobicContact CD2-CG 4.16Å; R88-L116 HydrophobicContact CB-CD2 4.13Å; Y112-L116 WeakPolarHBondContact O-CB 3.26Å; Y112-L116 PolarHBondContact O-N 3.11Å; M113-L116 PolarHBondContact O-N 3.34Å; A114-L116 VanDerWaalsContact C-N 3.33Å; A114-L116 PolarHBondContact O-N 2.9Å; L116-Y120 HydrophobicContact CD1-CD2 4.42Å; L116-Y120 HydrophobicContact CD1-CE2 3.85Å; L116-Y120 WeakPolarHBondContact O-CD2 3.44Å; L116-F129 HydrophobicContact CG-CE2 4.48Å
117	K	97.7	Very high	94.6	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.6	-46.7	175	-71	-179.2	-176.4	-176	0	111.6	L85 M113 A114 Q115 K119 Y120 T121 F129 V131 T149 D150	L85-K117 VanDerWaalsContact CD1-CE 3.46Å; L85-K117 HydrophobicContact CD1-CG 4.36Å; L85-K117 HydrophobicContact CD2-CG 4.42Å; M113-K117 WeakPolarHBondContact O-CG 3.44Å; M113-K117 PolarHBondContact O-N 3.23Å; A114-K117 PolarHBondContact O-N 2.97Å; Q115-K117 VanDerWaalsContact C-N 3.34Å; Q115-K117 PolarHBondContact O-N 2.84Å; K117-K119 VanDerWaalsContact C-N 3.3Å; K117-K119 PolarHBondContact O-N 2.96Å; K117-Y120 WeakPolarHBondContact O-CB 3.33Å; K117-Y120 PolarHBondContact O-N 2.68Å; K117-T121 PolarHBondContact O-N 2.69Å; K117-F129 HydrophobicContact CB-CD2 4.47Å; K117-F129 HydrophobicContact CG-CB 4.47Å; K117-F129 HydrophobicContact CG-CD2 4.04Å; K117-V131 PolarHBondContact NZ-O 3.43Å; K117-T149 WeakPolarHBondContact CE-OG1 3.44Å; K117-T149 PolarHBondContact NZ-O 3.18Å; K117-T149 PolarHBondContact NZ-OG1 3.36Å; K117-D150 WeakPolarHBondContact CD-O 3.48Å
118	Q	96.2	Very high	94.5	Very high	74 Å²	74	57 Å²	57	35%	0.346	28%	0.278	S	S	.	.	H	α-helix	trans	-56.6	-43.4	177.8	-166.2	-93.5	17.6	0	0	111.6	A114 Q115 Y120 T121	A114-Q118 WeakPolarHBondContact O-CB 3.48Å; A114-Q118 PolarHBondContact O-N 3.31Å; Q115-Q118 PolarHBondContact O-N 3.44Å; Q118-Y120 PolarHBondContact O-N 2.89Å; Q118-Y120 VanDerWaalsContact O-N 3.1Å; Q118-T121 WeakPolarHBondContact O-CB 3.35Å; Q118-T121 PolarHBondContact O-N 2.7Å; Q118-T121 PolarHBondContact O-OG1 3.15Å
119	K	95.6	Very high	94.5	Very high	122 Å²	122	54.9 Å²	54.9	53%	0.53	27%	0.27	S	S	.	.	H	α-helix	trans	-57.3	-31.6	177.9	-174.6	171.2	-176.4	168.9	0	112.5	Q115 K117 T121 Q122 S123	Q115-K119 WeakPolarHBondContact O-CB 3.49Å; Q115-K119 PolarHBondContact O-N 3.34Å; K117-K119 VanDerWaalsContact C-N 3.3Å; K117-K119 PolarHBondContact O-N 2.96Å; K119-T121 VanDerWaalsContact C-N 3.31Å; K119-Q122 PolarHBondContact O-N 3.16Å; K119-S123 VanDerWaalsContact O-CB 3.32Å; K119-S123 WeakPolarHBondContact O-CB 3.22Å; K119-S123 PolarHBondContact O-N 3.45Å; K119-S123 VanDerWaalsContact O-N 3.17Å; K119-S123 PolarHBondContact O-OG 3.25Å
120	Y	94.5	Very high	94.4	Very high	25 Å²	25	55 Å²	55	10%	0.098	27%	0.271	C	S	.	.	H	α-helix	trans	-80.9	-7	177.2	-80.7	-117.6	0	0	0	113.6	I9 R88 L116 K117 Q118 R126 F129	I9-Y120 WeakPolarHBondContact CD1-O 3.47Å; R88-Y120 PolarHBondContact NH1-OH 2.89Å; R88-Y120 PolarHBondContact NH2-OH 3.48Å; R88-Y120 VanDerWaalsContact NH2-OH 3.14Å; L116-Y120 HydrophobicContact CD1-CD2 4.42Å; L116-Y120 HydrophobicContact CD1-CE2 3.85Å; L116-Y120 WeakPolarHBondContact O-CD2 3.44Å; K117-Y120 WeakPolarHBondContact O-CB 3.33Å; K117-Y120 PolarHBondContact O-N 2.68Å; Q118-Y120 PolarHBondContact O-N 2.89Å; Q118-Y120 VanDerWaalsContact O-N 3.1Å; Y120-R126 HydrophobicContact CD1-CB 3.86Å; Y120-R126 HydrophobicContact CD1-CG 4.39Å; Y120-R126 HydrophobicContact CE1-CB 4.31Å; Y120-R126 HydrophobicContact CE1-CG 4.41Å; Y120-F129 HydrophobicContact CD1-CD2 4.28Å; Y120-F129 AromaticContact CD1-CE2 3.67Å; Y120-F129 HydrophobicContact CD1-CE2 3.67Å; Y120-F129 AromaticContact CD1-CZ 3.92Å; Y120-F129 HydrophobicContact CD1-CZ 3.92Å; Y120-F129 HydrophobicContact CD2-CD2 4.39Å; Y120-F129 AromaticContact CD2-CE2 3.5Å; Y120-F129 HydrophobicContact CD2-CE2 3.5Å; Y120-F129 HydrophobicContact CD2-CZ 4.16Å; Y120-F129 HydrophobicContact CE1-CE1 4.48Å; Y120-F129 AromaticContact CE1-CE2 3.88Å; Y120-F129 HydrophobicContact CE1-CE2 3.88Å; Y120-F129 AromaticContact CE1-CZ 3.68Å; Y120-F129 HydrophobicContact CE1-CZ 3.68Å; Y120-F129 AromaticContact CE2-CE2 3.7Å; Y120-F129 HydrophobicContact CE2-CE2 3.7Å; Y120-F129 AromaticContact CE2-CZ 3.91Å; Y120-F129 HydrophobicContact CE2-CZ 3.91Å; Y120-F129 HydrophobicContact CG-CD2 4.03Å; Y120-F129 AromaticContact CG-CE2 3.46Å; Y120-F129 HydrophobicContact CG-CE2 3.46Å; Y120-F129 VanDerWaalsContact CG-CE2 3.46Å; Y120-F129 HydrophobicContact CG-CZ 4.15Å; Y120-F129 AromaticContact CZ-CE2 3.87Å; Y120-F129 AromaticContact CZ-CZ 3.65Å
121	T	92.7	Very high	94.4	Very high	6 Å²	6	55 Å²	55	4%	0.037	27%	0.271	C	S	.	.	H	α-helix	trans	-87	-18.5	170.4	76.7	0	0	0	0	112.2	I9 V21 K117 Q118 K119 P128	I9-T121 WeakPolarHBondContact CD1-O 3.39Å; V21-T121 HydrophobicContact CG2-CG2 3.64Å; K117-T121 PolarHBondContact O-N 2.69Å; Q118-T121 WeakPolarHBondContact O-CB 3.35Å; Q118-T121 PolarHBondContact O-N 2.7Å; Q118-T121 PolarHBondContact O-OG1 3.15Å; K119-T121 VanDerWaalsContact C-N 3.31Å; T121-P128 HydrophobicContact CG2-CB 4.49Å
122	Q	88.6	Confident	94.4	Very high	113 Å²	113	50.3 Å²	50.3	53%	0.528	25%	0.254	S	S	.	.	H	α-helix	trans	-116.4	-7.1	-175.6	-54.7	-175	5.5	0	0	114.3	K119	K119-Q122 PolarHBondContact O-N 3.16Å
123	S	88.3	Confident	94.4	Very high	31 Å²	31	47.3 Å²	47.3	22%	0.217	24%	0.242	C	C	.	.	S	Bend	trans	-91.5	114.7	-179.4	-62.5	0	0	0	0	112.4	I9 K119 R126	I9-S123 WeakPolarHBondContact CD1-O 3.39Å; K119-S123 VanDerWaalsContact O-CB 3.32Å; K119-S123 WeakPolarHBondContact O-CB 3.22Å; K119-S123 PolarHBondContact O-N 3.45Å; K119-S123 VanDerWaalsContact O-N 3.17Å; K119-S123 PolarHBondContact O-OG 3.25Å; S123-R126 PolarHBondContact O-N 2.79Å
124	N	83.6	Confident	94.4	Very high	127 Å²	127	47.2 Å²	47.2	68%	0.679	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51	142	174.3	-69.8	-33	0	0	0	112.4	T10 R126	T10-N124 WeakPolarHBondContact CG2-OD1 3.4Å; T10-N124 PolarHBondContact OG1-OD1 3.43Å; N124-R126 VanDerWaalsContact C-N 3.26Å; N124-R126 PolarHBondContact O-N 2.93Å
125	G	85	Confident	94.5	Very high	90 Å²	90	47.2 Å²	47.2	93%	0.928	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.4	4.5	177.1	0	0	0	0	0	115.5
126	R	88.8	Confident	94.5	Very high	116 Å²	116	41.8 Å²	41.8	44%	0.438	22%	0.216	S	C	.	.			trans	-113.8	153.3	171.7	-57.9	-172.8	-173.2	179.9	2.7	109.8	I9 Y120 S123 N124	I9-R126 WeakPolarHBondContact CD1-O 3.31Å; Y120-R126 HydrophobicContact CD1-CB 3.86Å; Y120-R126 HydrophobicContact CD1-CG 4.39Å; Y120-R126 HydrophobicContact CE1-CB 4.31Å; Y120-R126 HydrophobicContact CE1-CG 4.41Å; S123-R126 PolarHBondContact O-N 2.79Å; N124-R126 VanDerWaalsContact C-N 3.26Å; N124-R126 PolarHBondContact O-N 2.93Å
127	R	92.8	Very high	94.5	Very high	130 Å²	130	40.8 Å²	40.8	49%	0.491	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-99.7	148.6	168.5	62.5	170.3	-178.8	74.5	0.1	110.1	D81	D81-R127 VanDerWaalsContact CG-NH1 3.29Å; D81-R127 IonicContact OD1-CZ 3.78Å; D81-R127 IonicContact OD1-NH1 3.47Å; D81-R127 PolarHBondContact OD1-NH1 2.87Å; D81-R127 VanDerWaalsContact OD1-NH1 3.14Å; D81-R127 IonicContact OD1-NH2 2.73Å; D81-R127 PolarHBondContact OD1-NH2 3.39Å; D81-R127 IonicContact OD2-CZ 3.52Å; D81-R127 IonicContact OD2-NH1 3.48Å; D81-R127 PolarHBondContact OD2-NH1 2.88Å; D81-R127 IonicContact OD2-NH2 3.48Å
128	P	96	Very high	94.5	Very high	5 Å²	5	40.8 Å²	40.8	3%	0.032	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-56.9	152	169.4	-23.7	35.1	0	0	0	111.1	I9 Q20 V21 A24 T121 G130	I9-P128 HydrophobicContact CG2-CG 4.17Å; Q20-P128 HydrophobicContact CB-CG 4.33Å; V21-P128 HydrophobicContact CG2-CG 4.19Å; A24-P128 HydrophobicContact CB-CB 3.93Å; T121-P128 HydrophobicContact CG2-CB 4.49Å; P128-G130 PolarHBondContact O-N 3.36Å
129	F	97.7	Very high	94.5	Very high	6 Å²	6	38.4 Å²	38.4	3%	0.026	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-73	122.4	174	-68.8	-80.1	0	0	0	109.7	D81 I84 L85 L116 K117 Y120 V131 P151	D81-F129 HydrophobicContact CB-CD1 3.89Å; D81-F129 WeakPolarHBondContact OD2-CA 3.42Å; I84-F129 HydrophobicContact CB-CE1 4.39Å; I84-F129 HydrophobicContact CG2-CE1 4.08Å; I84-F129 HydrophobicContact CG2-CZ 4.42Å; L85-F129 HydrophobicContact CD1-CB 4.35Å; L85-F129 HydrophobicContact CD1-CD1 4.23Å; L85-F129 HydrophobicContact CD1-CG 4.19Å; L85-F129 HydrophobicContact CD2-CD1 4.14Å; L85-F129 HydrophobicContact CD2-CD2 3.99Å; L85-F129 HydrophobicContact CD2-CE1 3.9Å; L85-F129 HydrophobicContact CD2-CE2 3.73Å; L85-F129 HydrophobicContact CD2-CG 4.17Å; L85-F129 HydrophobicContact CD2-CZ 3.68Å; L85-F129 HydrophobicContact CG-CD1 3.99Å; L85-F129 HydrophobicContact CG-CE1 4Å; L85-F129 HydrophobicContact CG-CG 4.28Å; L85-F129 HydrophobicContact CG-CZ 4.31Å; L116-F129 HydrophobicContact CG-CE2 4.48Å; K117-F129 HydrophobicContact CB-CD2 4.47Å; K117-F129 HydrophobicContact CG-CB 4.47Å; K117-F129 HydrophobicContact CG-CD2 4.04Å; Y120-F129 HydrophobicContact CD1-CD2 4.28Å; Y120-F129 AromaticContact CD1-CE2 3.67Å; Y120-F129 HydrophobicContact CD1-CE2 3.67Å; Y120-F129 AromaticContact CD1-CZ 3.92Å; Y120-F129 HydrophobicContact CD1-CZ 3.92Å; Y120-F129 HydrophobicContact CD2-CD2 4.39Å; Y120-F129 AromaticContact CD2-CE2 3.5Å; Y120-F129 HydrophobicContact CD2-CE2 3.5Å; Y120-F129 HydrophobicContact CD2-CZ 4.16Å; Y120-F129 HydrophobicContact CE1-CE1 4.48Å; Y120-F129 AromaticContact CE1-CE2 3.88Å; Y120-F129 HydrophobicContact CE1-CE2 3.88Å; Y120-F129 AromaticContact CE1-CZ 3.68Å; Y120-F129 HydrophobicContact CE1-CZ 3.68Å; Y120-F129 AromaticContact CE2-CE2 3.7Å; Y120-F129 HydrophobicContact CE2-CE2 3.7Å; Y120-F129 AromaticContact CE2-CZ 3.91Å; Y120-F129 HydrophobicContact CE2-CZ 3.91Å; Y120-F129 HydrophobicContact CG-CD2 4.03Å; Y120-F129 AromaticContact CG-CE2 3.46Å; Y120-F129 HydrophobicContact CG-CE2 3.46Å; Y120-F129 VanDerWaalsContact CG-CE2 3.46Å; Y120-F129 HydrophobicContact CG-CZ 4.15Å; Y120-F129 AromaticContact CZ-CE2 3.87Å; Y120-F129 AromaticContact CZ-CZ 3.65Å; F129-V131 HydrophobicContact CB-CG2 4.11Å; F129-V131 PolarHBondContact O-N 3.19Å; F129-P151 VanDerWaalsContact O-CB 3.23Å; F129-P151 WeakPolarHBondContact O-CB 3.48Å; F129-P151 WeakPolarHBondContact O-CG 3.48Å
130	G	97.6	Very high	94.4	Very high	2 Å²	2	37.3 Å²	37.3	2%	0.021	20%	0.197	C	C	.	.			trans	-81.9	46.2	177.8	0	0	0	0	0	112.7	G77 L78 D81 P128	G77-G130 CarbonylContact C-O 3.52Å; G77-G130 VanDerWaalsContact CA-O 3.28Å; G77-G130 WeakPolarHBondContact CA-O 3.23Å; L78-G130 PolarHBondContact N-O 2.8Å; D81-G130 PolarHBondContact OD2-N 2.7Å; P128-G130 PolarHBondContact O-N 3.36Å
131	V	98.2	Very high	94.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	136.7	-178.2	-63.8	0	0	0	0	113.2	A76 L78 D81 A82 L85 K117 F129	A76-V131 VanDerWaalsContact O-CA 3.24Å; A76-V131 WeakPolarHBondContact O-CA 3.44Å; L78-V131 HydrophobicContact CB-CG1 4.42Å; L78-V131 WeakPolarHBondContact O-CG1 3.28Å; D81-V131 HydrophobicContact CB-CG1 3.77Å; D81-V131 HydrophobicContact CB-CG2 4.18Å; A82-V131 HydrophobicContact CB-CG1 4.23Å; L85-V131 HydrophobicContact CD1-CG2 3.4Å; K117-V131 PolarHBondContact NZ-O 3.43Å; F129-V131 HydrophobicContact CB-CG2 4.11Å; F129-V131 PolarHBondContact O-N 3.19Å
132	S	98.5	Very high	94.4	Very high	4 Å²	4	42 Å²	42	3%	0.028	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	148.5	159.5	-62.6	0	0	0	0	109	V28 F75 A76 T149 D150 I163	V28-S132 WeakPolarHBondContact CG1-OG 3.36Å; F75-S132 WeakPolarHBondContact CA-O 3.46Å; A76-S132 PolarHBondContact N-O 3.28Å; A76-S132 PolarHBondContact O-N 3.19Å; S132-T149 CarbonylContact C-O 3.56Å; S132-T149 WeakPolarHBondContact CA-O 3.16Å; S132-D150 WeakPolarHBondContact CB-OD1 3.25Å; S132-D150 PolarHBondContact OG-OD1 3.05Å; S132-I163 VanDerWaalsContact O-CD1 3.29Å; S132-I163 WeakPolarHBondContact O-CD1 3.25Å
133	T	98.7	Very high	94.8	Very high	4 Å²	4	39 Å²	39	3%	0.025	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	144.1	-179.5	62.1	0	0	0	0	110.4	V73 A74 F75 M113 Q148 T149	V73-T133 HydrophobicContact CG2-CG2 4.07Å; A74-T133 CarbonylContact O-C 3.54Å; A74-T133 VanDerWaalsContact O-CA 3.25Å; A74-T133 WeakPolarHBondContact O-CA 3.42Å; F75-T133 HydrophobicContact CB-CG2 4.08Å; M113-T133 HydrophobicContact CE-CG2 4.47Å; M113-T133 HydrophobicContact SD-CG2 3.74Å; M113-T133 PolarHBondContact SD-OG1 2.88Å; T133-Q148 CarbonylContact O-C 3.57Å; T133-Q148 VanDerWaalsContact O-CA 3.25Å; T133-Q148 WeakPolarHBondContact O-CA 3.4Å; T133-T149 PolarHBondContact N-O 2.88Å; T133-T149 PolarHBondContact O-N 2.95Å; T133-T149 PolarHBondContact OG1-OG1 3.4Å
134	L	98.8	Very high	95.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	113.4	162.5	-66.1	176.1	0	0	0	107.1	A34 L45 V73 A74 L146 Y147 Q148 N161 I163	A34-L134 HydrophobicContact CB-CD1 4.47Å; L45-L134 HydrophobicContact CD2-CB 4.14Å; V73-L134 CarbonylContact C-O 3.56Å; V73-L134 VanDerWaalsContact CA-O 3.25Å; V73-L134 WeakPolarHBondContact CA-O 3.42Å; V73-L134 WeakPolarHBondContact CG2-O 3.11Å; A74-L134 HydrophobicContact CB-CB 4.5Å; A74-L134 PolarHBondContact N-O 3.09Å; A74-L134 PolarHBondContact O-N 3.45Å; L134-L146 HydrophobicContact CB-CD1 4.12Å; L134-L146 HydrophobicContact CD2-CD1 4.37Å; L134-Y147 CarbonylContact C-O 3.58Å; L134-Y147 WeakPolarHBondContact CA-O 3.46Å; L134-Q148 HydrophobicContact CD2-CB 4.15Å; L134-Q148 HydrophobicContact CD2-CG 4.48Å; L134-N161 HydrophobicContact CD2-CB 4.31Å; L134-I163 HydrophobicContact CD1-CD1 4.42Å; L134-I163 HydrophobicContact CD1-CG1 4.04Å; L134-I163 HydrophobicContact CD2-CG2 4.03Å; L134-I163 HydrophobicContact CG-CD1 3.87Å; L134-I163 HydrophobicContact CG-CG1 3.95Å; L134-I163 HydrophobicContact CG-CG2 4.24Å
135	I	98.8	Very high	96	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.1	177.4	-58	166.7	0	0	0	106.4	L67 V71 A72 V73 L106 I109 A110 M113 L146 Y147 T149	L67-I135 HydrophobicContact CD1-CG2 4.34Å; V71-I135 HydrophobicContact CG1-CG2 3.73Å; A72-I135 CarbonylContact O-C 3.5Å; A72-I135 WeakPolarHBondContact O-CA 3.1Å; V73-I135 HydrophobicContact CB-CG1 4.47Å; V73-I135 HydrophobicContact CG2-CG1 3.93Å; L106-I135 HydrophobicContact CD1-CG2 4.15Å; I109-I135 HydrophobicContact CG2-CD1 4.43Å; I109-I135 HydrophobicContact CG2-CG2 4.46Å; A110-I135 HydrophobicContact CB-CD1 4.26Å; M113-I135 HydrophobicContact CB-CD1 4.43Å; M113-I135 HydrophobicContact CE-CD1 3.67Å; M113-I135 HydrophobicContact CE-CG1 4.15Å; M113-I135 HydrophobicContact SD-CD1 3.92Å; I135-L146 CarbonylContact O-C 3.6Å; I135-L146 WeakPolarHBondContact O-CA 3.49Å; I135-Y147 PolarHBondContact N-O 3.32Å; I135-Y147 PolarHBondContact O-N 3.03Å; I135-T149 HydrophobicContact CD1-CG2 3.82Å
136	C	98.6	Very high	96.6	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.007	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	161.2	178.3	71	0	0	0	0	111.6	V43 L45 A72 H145 L146	V43-C136 HydrophobicContact CB-CB 4.14Å; V43-C136 HydrophobicContact CG2-CB 3.99Å; L45-C136 VanDerWaalsContact CD1-SG 3.55Å; L45-C136 VanDerWaalsContact CG-SG 3.5Å; A72-C136 PolarHBondContact N-O 3.01Å; A72-C136 PolarHBondContact O-N 3.26Å; C136-H145 WeakPolarHBondContact CA-O 3.35Å; C136-H145 WeakPolarHBondContact CB-O 3.28Å; C136-L146 HydrophobicContact CB-CD1 3.87Å
137	G	98.4	Very high	97.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.5	-160.1	175.3	0	0	0	0	0	111.8	H70 P144 H145	H70-G137 VanDerWaalsContact O-CA 3.26Å; H70-G137 WeakPolarHBondContact O-CA 3.33Å; G137-P144 WeakPolarHBondContact O-CA 3.3Å; G137-H145 PolarHBondContact N-O 3.23Å; G137-H145 VanDerWaalsContact N-O 3.1Å; G137-H145 PolarHBondContact O-N 3.09Å
138	F	98.1	Very high	97.4	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	137.7	175.7	-72	-92.3	0	0	0	110.5	V43 H70 L106 G142 T143 P144 M213 W215 F225 V226	V43-F138 HydrophobicContact CG1-CE2 4.49Å; V43-F138 HydrophobicContact CG2-CE2 4.15Å; H70-F138 PolarHBondContact CD2-O 3.22Å; H70-F138 PolarHBondContact O-N 3.13Å; L106-F138 WeakPolarHBondContact CD2-O 3.33Å; F138-G142 WeakPolarHBondContact CD1-O 3.29Å; F138-T143 WeakPolarHBondContact CA-O 3.24Å; F138-P144 HydrophobicContact CD1-CB 3.99Å; F138-P144 HydrophobicContact CE1-CB 3.5Å; F138-P144 VanDerWaalsContact CE1-CB 3.5Å; F138-P144 HydrophobicContact CE1-CG 3.94Å; F138-P144 HydrophobicContact CZ-CB 3.85Å; F138-M213 HydrophobicContact CD2-CG 4.08Å; F138-M213 HydrophobicContact CD2-SD 4.15Å; F138-M213 HydrophobicContact CE2-CB 4.44Å; F138-M213 HydrophobicContact CE2-CG 4.27Å; F138-W215 HydrophobicContact CB-CE3 3.8Å; F138-W215 HydrophobicContact CB-CZ3 4.1Å; F138-W215 HydrophobicContact CD1-CB 3.93Å; F138-W215 HydrophobicContact CD1-CD2 4.4Å; F138-W215 AromaticContact CD1-CE3 3.89Å; F138-W215 HydrophobicContact CD1-CE3 3.89Å; F138-W215 HydrophobicContact CD1-CG 4.45Å; F138-W215 HydrophobicContact CE1-CB 3.64Å; F138-W215 HydrophobicContact CG-CB 4.47Å; F138-W215 AromaticContact CG-CE3 3.94Å; F138-W215 HydrophobicContact CG-CE3 3.94Å; F138-W215 HydrophobicContact CZ-CB 3.96Å; F138-F225 HydrophobicContact CB-CE2 4.49Å; F138-V226 HydrophobicContact CB-CG1 3.87Å; F138-V226 HydrophobicContact CD2-CG1 3.9Å; F138-V226 HydrophobicContact CG-CG1 4.19Å
139	N	96.3	Very high	97.5	Very high	25 Å²	25	18.8 Å²	18.8	13%	0.134	10%	0.103	C	C	.	.			trans	-75.5	166.4	163	-72.8	-25.6	0	0	0	109.7	S105 L106 D141 G142 T143 H145 W215	S105-N139 VanDerWaalsContact CA-OD1 3.29Å; S105-N139 WeakPolarHBondContact CA-OD1 3.45Å; S105-N139 WeakPolarHBondContact CB-OD1 3.31Å; L106-N139 WeakPolarHBondContact CD2-OD1 3.26Å; L106-N139 PolarHBondContact N-OD1 3.37Å; N139-D141 VanDerWaalsContact CB-OD1 3.24Å; N139-D141 WeakPolarHBondContact CB-OD1 3.32Å; N139-D141 PolarHBondContact O-N 3.32Å; N139-D141 VanDerWaalsContact O-N 3.1Å; N139-G142 PolarHBondContact O-N 2.93Å; N139-T143 PolarHBondContact N-O 2.97Å; N139-H145 PolarHBondContact ND2-CD2 3.47Å; N139-H145 PolarHBondContact ND2-NE2 3.31Å; N139-W215 WeakPolarHBondContact O-CZ3 3.23Å
140	Q	92.9	Very high	97.5	Very high	98 Å²	98	19.6 Å²	19.6	46%	0.458	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-19.3	179.1	-81.9	177.6	-51.6	0	0	114.5	D102 P103 G142 W215 F225	D102-Q140 PolarHBondContact OD1-NE2 3.1Å; P103-Q140 HydrophobicContact CG-CG 3.36Å; P103-Q140 VanDerWaalsContact CG-NE2 3.34Å; Q140-G142 PolarHBondContact O-N 3.2Å; Q140-W215 WeakPolarHBondContact O-CH2 3.44Å; Q140-F225 HydrophobicContact CG-CD1 4.46Å; Q140-F225 HydrophobicContact CG-CE1 3.93Å; Q140-F225 HydrophobicContact CG-CZ 4.07Å
141	D	92.9	Very high	97.5	Very high	111 Å²	111	19.5 Å²	19.5	59%	0.594	11%	0.107	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-0.3	176.7	64.8	-4.4	0	0	0	113.3	N139 T143	N139-D141 VanDerWaalsContact CB-OD1 3.24Å; N139-D141 WeakPolarHBondContact CB-OD1 3.32Å; N139-D141 PolarHBondContact O-N 3.32Å; N139-D141 VanDerWaalsContact O-N 3.1Å; D141-T143 VanDerWaalsContact C-N 3.35Å; D141-T143 VanDerWaalsContact CG-OG1 3.27Å; D141-T143 WeakPolarHBondContact OD1-CB 3.38Å; D141-T143 PolarHBondContact OD1-N 2.93Å; D141-T143 PolarHBondContact OD1-OG1 2.94Å; D141-T143 WeakPolarHBondContact OD2-CG2 3.42Å; D141-T143 PolarHBondContact OD2-OG1 2.87Å
142	G	94.8	Very high	97.4	Very high	18 Å²	18	21.2 Å²	21.2	19%	0.186	12%	0.119	C	C	.	.	S	Bend	trans	85.4	4.3	-178.8	0	0	0	0	0	114.8	F138 N139 Q140 P144 W215	F138-G142 WeakPolarHBondContact CD1-O 3.29Å; N139-G142 PolarHBondContact O-N 2.93Å; Q140-G142 PolarHBondContact O-N 3.2Å; G142-P144 WeakPolarHBondContact O-CD 3.14Å; G142-W215 VanDerWaalsContact CA-CH2 3.46Å; G142-W215 VanDerWaalsContact CA-CZ3 3.41Å
143	T	96.4	Very high	97.3	Very high	51 Å²	51	21.8 Å²	21.8	31%	0.313	13%	0.125	S	C	.	.			trans	-79.7	127.1	179.2	57.5	0	0	0	0	111.5	F138 N139 D141 H145	F138-T143 WeakPolarHBondContact CA-O 3.24Å; N139-T143 PolarHBondContact N-O 2.97Å; D141-T143 VanDerWaalsContact C-N 3.35Å; D141-T143 VanDerWaalsContact CG-OG1 3.27Å; D141-T143 WeakPolarHBondContact OD1-CB 3.38Å; D141-T143 PolarHBondContact OD1-N 2.93Å; D141-T143 PolarHBondContact OD1-OG1 2.94Å; D141-T143 WeakPolarHBondContact OD2-CG2 3.42Å; D141-T143 PolarHBondContact OD2-OG1 2.87Å; T143-H145 PolarHBondContact O-CD2 3.39Å; T143-H145 VanDerWaalsContact O-CD2 3.26Å; T143-H145 PolarHBondContact OG1-NE2 2.89Å
144	P	97.9	Very high	97.2	Very high	19 Å²	19	24.1 Å²	24.1	12%	0.123	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	141	174.4	24.9	-25.3	0	0	0	111.5	R38 V43 G137 F138 G142	R38-P144 WeakPolarHBondContact CD-O 3.42Å; R38-P144 HydrophobicContact CG-CB 3.84Å; R38-P144 HydrophobicContact CG-CG 3.91Å; R38-P144 PolarHBondContact NH1-O 2.9Å; V43-P144 HydrophobicContact CG1-CB 3.61Å; G137-P144 WeakPolarHBondContact O-CA 3.3Å; F138-P144 HydrophobicContact CD1-CB 3.99Å; F138-P144 HydrophobicContact CE1-CB 3.5Å; F138-P144 VanDerWaalsContact CE1-CB 3.5Å; F138-P144 HydrophobicContact CE1-CG 3.94Å; F138-P144 HydrophobicContact CZ-CB 3.85Å; G142-P144 WeakPolarHBondContact O-CD 3.14Å
145	H	98.5	Very high	97.2	Very high	24 Å²	24	27 Å²	27	11%	0.111	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	149.4	178.3	-65.9	-82.6	0	0	0	112.5	L106 C136 G137 N139 T143 Y147 E157	L106-H145 HydrophobicContact CB-CB 3.84Å; L106-H145 HydrophobicContact CG-CB 4.01Å; C136-H145 WeakPolarHBondContact CA-O 3.35Å; C136-H145 WeakPolarHBondContact CB-O 3.28Å; G137-H145 PolarHBondContact N-O 3.23Å; G137-H145 VanDerWaalsContact N-O 3.1Å; G137-H145 PolarHBondContact O-N 3.09Å; N139-H145 PolarHBondContact ND2-CD2 3.47Å; N139-H145 PolarHBondContact ND2-NE2 3.31Å; T143-H145 PolarHBondContact O-CD2 3.39Å; T143-H145 VanDerWaalsContact O-CD2 3.26Å; T143-H145 PolarHBondContact OG1-NE2 2.89Å; H145-Y147 HydrophobicContact CB-CD2 4.2Å; H145-Y147 HydrophobicContact CB-CE2 3.72Å; H145-E157 IonicContact CE1-OE1 3.82Å; H145-E157 IonicContact CG-OE1 3.31Å; H145-E157 IonicContact ND1-OE1 3.69Å; H145-E157 PolarHBondContact ND1-OE1 2.84Å
146	L	98.8	Very high	97.2	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	113.2	173.4	172	69	0	0	0	109	G36 L134 I135 C136 E157 W158	G36-L146 VanDerWaalsContact C-CD2 3.46Å; G36-L146 VanDerWaalsContact O-CD2 3.31Å; G36-L146 WeakPolarHBondContact O-CD2 3.41Å; L134-L146 HydrophobicContact CB-CD1 4.12Å; L134-L146 HydrophobicContact CD2-CD1 4.37Å; I135-L146 CarbonylContact O-C 3.6Å; I135-L146 WeakPolarHBondContact O-CA 3.49Å; C136-L146 HydrophobicContact CB-CD1 3.87Å; L146-E157 CarbonylContact O-C 3.53Å; L146-E157 WeakPolarHBondContact O-CA 3.32Å; L146-W158 WeakPolarHBondContact CB-O 2.84Å; L146-W158 HydrophobicContact CD2-CB 4.15Å; L146-W158 HydrophobicContact CG-CB 4.37Å; L146-W158 PolarHBondContact O-N 3.29Å
147	Y	98.8	Very high	97.1	Very high	11 Å²	11	36 Å²	36	4%	0.043	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	139.1	177.4	-70.3	-84.4	0	0	0	111.4	L106 E107 A110 L134 I135 H145 F156 E157	L106-Y147 HydrophobicContact CB-CD2 3.95Å; L106-Y147 HydrophobicContact CB-CE2 3.75Å; E107-Y147 HydrophobicContact CB-CE2 4.3Å; E107-Y147 HydrophobicContact CG-CE1 4.43Å; A110-Y147 HydrophobicContact CB-CD1 3.93Å; A110-Y147 HydrophobicContact CB-CD2 4.05Å; A110-Y147 HydrophobicContact CB-CG 3.56Å; L134-Y147 CarbonylContact C-O 3.58Å; L134-Y147 WeakPolarHBondContact CA-O 3.46Å; I135-Y147 PolarHBondContact N-O 3.32Å; I135-Y147 PolarHBondContact O-N 3.03Å; H145-Y147 HydrophobicContact CB-CD2 4.2Å; H145-Y147 HydrophobicContact CB-CE2 3.72Å; Y147-F156 CarbonylContact C-O 3.54Å; Y147-F156 VanDerWaalsContact CA-O 3.29Å; Y147-F156 WeakPolarHBondContact CA-O 3.32Å; Y147-E157 HydrophobicContact CD1-CB 3.87Å; Y147-E157 HydrophobicContact CD1-CG 4.2Å; Y147-E157 HydrophobicContact CE1-CB 3.5Å; Y147-E157 VanDerWaalsContact CE1-CB 3.5Å; Y147-E157 HydrophobicContact CE1-CG 3.74Å; Y147-E157 HydrophobicContact CE2-CG 4.42Å; Y147-E157 VanDerWaalsContact OH-CD 3.29Å; Y147-E157 PolarHBondContact OH-OE2 3.42Å
148	Q	98.6	Very high	97.2	Very high	20 Å²	20	40.1 Å²	40.1	9%	0.093	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	142.8	163.2	-179	-178.5	-11.1	0	0	109.4	T133 L134 D150 H155 F156 N161 I163	T133-Q148 CarbonylContact O-C 3.57Å; T133-Q148 VanDerWaalsContact O-CA 3.25Å; T133-Q148 WeakPolarHBondContact O-CA 3.4Å; L134-Q148 HydrophobicContact CD2-CB 4.15Å; L134-Q148 HydrophobicContact CD2-CG 4.48Å; Q148-D150 PolarHBondContact NE2-OD1 2.83Å; Q148-D150 PolarHBondContact NE2-OD2 2.96Å; Q148-H155 CarbonylContact O-C 3.42Å; Q148-H155 WeakPolarHBondContact O-CA 3.38Å; Q148-H155 WeakPolarHBondContact O-CB 3.27Å; Q148-F156 PolarHBondContact N-O 3.25Å; Q148-F156 PolarHBondContact O-N 2.85Å; Q148-N161 PolarHBondContact OE1-ND2 3.1Å; Q148-I163 HydrophobicContact CG-CG2 4.14Å
149	T	98.6	Very high	97.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	140.5	161.9	81.7	0	0	0	0	111.2	A110 M113 K117 S132 T133 I135 T154 H155	A110-T149 HydrophobicContact CB-CG2 4.34Å; A110-T149 WeakPolarHBondContact O-CG2 3.47Å; M113-T149 HydrophobicContact CB-CG2 4.42Å; M113-T149 HydrophobicContact SD-CG2 4.42Å; M113-T149 PolarHBondContact SD-OG1 2.8Å; K117-T149 WeakPolarHBondContact CE-OG1 3.44Å; K117-T149 PolarHBondContact NZ-O 3.18Å; K117-T149 PolarHBondContact NZ-OG1 3.36Å; S132-T149 CarbonylContact C-O 3.56Å; S132-T149 WeakPolarHBondContact CA-O 3.16Å; T133-T149 PolarHBondContact N-O 2.88Å; T133-T149 PolarHBondContact O-N 2.95Å; T133-T149 PolarHBondContact OG1-OG1 3.4Å; I135-T149 HydrophobicContact CD1-CG2 3.82Å; T149-T154 WeakPolarHBondContact CA-O 3.33Å; T149-H155 HydrophobicContact CG2-CB 4.03Å
150	D	97.9	Very high	97.3	Very high	22 Å²	22	43.6 Å²	43.6	12%	0.118	23%	0.229	C	C	.	.			trans	-116.4	161.8	-174.7	-73.8	-43.5	0	0	0	113.4	K117 S132 Q148 S152 G153 T154	K117-D150 WeakPolarHBondContact CD-O 3.48Å; S132-D150 WeakPolarHBondContact CB-OD1 3.25Å; S132-D150 PolarHBondContact OG-OD1 3.05Å; Q148-D150 PolarHBondContact NE2-OD1 2.83Å; Q148-D150 PolarHBondContact NE2-OD2 2.96Å; D150-S152 PolarHBondContact O-N 2.89Å; D150-S152 VanDerWaalsContact O-N 3.09Å; D150-G153 PolarHBondContact O-N 2.91Å; D150-T154 PolarHBondContact N-O 3.19Å
151	P	97.5	Very high	97.6	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-30	177.1	-32	37.7	0	0	0	115.6	A24 Q25 V28 F129 G153	A24-P151 HydrophobicContact CB-CB 3.86Å; A24-P151 HydrophobicContact CB-CG 4.32Å; Q25-P151 HydrophobicContact CG-CB 4.18Å; Q25-P151 HydrophobicContact CG-CG 4.03Å; V28-P151 HydrophobicContact CG2-CG 3.83Å; F129-P151 VanDerWaalsContact O-CB 3.23Å; F129-P151 WeakPolarHBondContact O-CB 3.48Å; F129-P151 WeakPolarHBondContact O-CG 3.48Å; P151-G153 PolarHBondContact O-N 2.75Å
152	S	95.7	Very high	97.8	Very high	36 Å²	36	33.7 Å²	33.7	25%	0.252	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-16.4	175.8	45.2	0	0	0	0	113.6	D150 T154	D150-S152 PolarHBondContact O-N 2.89Å; D150-S152 VanDerWaalsContact O-N 3.09Å; S152-T154 PolarHBondContact OG-OG1 2.93Å
153	G	96.7	Very high	98	Very high	16 Å²	16	33.1 Å²	33.1	17%	0.165	17%	0.172	C	C	.	.	S	Bend	trans	81.4	23.1	-173.1	0	0	0	0	0	114	A114 D150 P151	A114-G153 WeakPolarHBondContact CB-O 3.44Å; A114-G153 WeakPolarHBondContact O-CA 3.4Å; D150-G153 PolarHBondContact O-N 2.91Å; P151-G153 PolarHBondContact O-N 2.75Å
154	T	97.1	Very high	98	Very high	53 Å²	53	31.1 Å²	31.1	33%	0.325	16%	0.161	S	C	.	.			trans	-89.2	151.3	167.5	50.5	0	0	0	0	110.5	T149 D150 S152 F156	T149-T154 WeakPolarHBondContact CA-O 3.33Å; D150-T154 PolarHBondContact N-O 3.19Å; S152-T154 PolarHBondContact OG-OG1 2.93Å; T154-F156 HydrophobicContact CG2-CZ 4.44Å
155	H	97.9	Very high	97.9	Very high	61 Å²	61	35.3 Å²	35.3	28%	0.282	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	148.1	169.5	62.7	-71.2	0	0	0	110.3	A110 A114 Q148 T149	A110-H155 HydrophobicContact CB-CB 4.45Å; A114-H155 HydrophobicContact CB-CB 3.96Å; Q148-H155 CarbonylContact O-C 3.42Å; Q148-H155 WeakPolarHBondContact O-CA 3.38Å; Q148-H155 WeakPolarHBondContact O-CB 3.27Å; T149-H155 HydrophobicContact CG2-CB 4.03Å
156	F	98	Very high	97.7	Very high	102 Å²	102	37.9 Å²	37.9	45%	0.447	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	143.3	-178.4	-58.4	-74.9	0	0	0	109.6	Y147 Q148 T154 W158	Y147-F156 CarbonylContact C-O 3.54Å; Y147-F156 VanDerWaalsContact CA-O 3.29Å; Y147-F156 WeakPolarHBondContact CA-O 3.32Å; Q148-F156 PolarHBondContact N-O 3.25Å; Q148-F156 PolarHBondContact O-N 2.85Å; T154-F156 HydrophobicContact CG2-CZ 4.44Å; F156-W158 HydrophobicContact CB-CZ2 4.23Å; F156-W158 PolarHBondContact O-NE1 2.79Å
157	E	98.5	Very high	97.6	Very high	89 Å²	89	38.3 Å²	38.3	42%	0.416	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	145.3	173.3	-162.5	170.4	170.2	0	0	111.1	R38 H145 L146 Y147	R38-E157 IonicContact NH1-OE1 3.78Å; H145-E157 IonicContact CE1-OE1 3.82Å; H145-E157 IonicContact CG-OE1 3.31Å; H145-E157 IonicContact ND1-OE1 3.69Å; H145-E157 PolarHBondContact ND1-OE1 2.84Å; L146-E157 CarbonylContact O-C 3.53Å; L146-E157 WeakPolarHBondContact O-CA 3.32Å; Y147-E157 HydrophobicContact CD1-CB 3.87Å; Y147-E157 HydrophobicContact CD1-CG 4.2Å; Y147-E157 HydrophobicContact CE1-CB 3.5Å; Y147-E157 VanDerWaalsContact CE1-CB 3.5Å; Y147-E157 HydrophobicContact CE1-CG 3.74Å; Y147-E157 HydrophobicContact CE2-CG 4.42Å; Y147-E157 VanDerWaalsContact OH-CD 3.29Å; Y147-E157 PolarHBondContact OH-OE2 3.42Å
158	W	98.6	Very high	97.6	Very high	85 Å²	85	44.4 Å²	44.4	32%	0.322	22%	0.223	S	C	.	.			trans	-138.9	149.4	-175.3	-61.5	87.3	0	0	0	111.9	L146 F156 N161	L146-W158 WeakPolarHBondContact CB-O 2.84Å; L146-W158 HydrophobicContact CD2-CB 4.15Å; L146-W158 HydrophobicContact CG-CB 4.37Å; L146-W158 PolarHBondContact O-N 3.29Å; F156-W158 HydrophobicContact CB-CZ2 4.23Å; F156-W158 PolarHBondContact O-NE1 2.79Å; W158-N161 HydrophobicContact CB-CB 3.87Å; W158-N161 HydrophobicContact CD2-CB 3.84Å; W158-N161 HydrophobicContact CE3-CB 4.16Å; W158-N161 HydrophobicContact CG-CB 3.68Å; W158-N161 PolarHBondContact NE1-ND2 2.88Å
159	L	98.4	Very high	97.5	Very high	85 Å²	85	46.7 Å²	46.7	45%	0.445	24%	0.238	S	C	.	.	S	Bend	trans	-74.2	-48.4	163.9	-63.8	-178.6	0	0	0	110.8	R38 Y178	R38-L159 WeakPolarHBondContact CB-O 3.48Å; R38-L159 PolarHBondContact N-O 2.93Å; L159-Y178 HydrophobicContact CB-CE1 3.99Å; L159-Y178 HydrophobicContact CB-CE2 4.06Å; L159-Y178 HydrophobicContact CD1-CD1 4.45Å; L159-Y178 HydrophobicContact CD1-CE1 3.88Å; L159-Y178 HydrophobicContact CG-CE1 4.43Å
160	A	98.7	Very high	97.5	Very high	14 Å²	14	46.7 Å²	46.7	12%	0.116	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	147.4	171.7	0	0	0	0	0	108.4	G36 V37 L174 Y178	G36-A160 CarbonylContact O-C 3.59Å; G36-A160 VanDerWaalsContact O-CA 3.26Å; G36-A160 WeakPolarHBondContact O-CA 3.33Å; V37-A160 HydrophobicContact CB-CB 4.42Å; V37-A160 HydrophobicContact CG1-CB 4.22Å; V37-A160 HydrophobicContact CG2-CB 4.2Å; A160-L174 HydrophobicContact CB-CB 4.5Å; A160-L174 HydrophobicContact CB-CD1 4.23Å; A160-L174 HydrophobicContact CB-CD2 4.16Å; A160-Y178 HydrophobicContact CB-CD2 3.63Å; A160-Y178 HydrophobicContact CB-CE2 3.96Å
161	N	98.5	Very high	97.5	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	159.9	-179.8	-164.7	11.3	0	0	0	112.1	I35 G36 L134 Q148 W158 R171	I35-N161 WeakPolarHBondContact CA-O 3.25Å; G36-N161 PolarHBondContact N-O 2.93Å; G36-N161 PolarHBondContact O-N 2.9Å; L134-N161 HydrophobicContact CD2-CB 4.31Å; Q148-N161 PolarHBondContact OE1-ND2 3.1Å; W158-N161 HydrophobicContact CB-CB 3.87Å; W158-N161 HydrophobicContact CD2-CB 3.84Å; W158-N161 HydrophobicContact CE3-CB 4.16Å; W158-N161 HydrophobicContact CG-CB 3.68Å; W158-N161 PolarHBondContact NE1-ND2 2.88Å; N161-R171 PolarHBondContact OD1-NE 3.29Å
162	A	98.5	Very high	97.5	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	141.1	176.3	0	0	0	0	0	110.9	A34 I35 A167 A170 R171 L174	A34-A162 CarbonylContact O-C 3.57Å; A34-A162 VanDerWaalsContact O-CA 3.32Å; A34-A162 WeakPolarHBondContact O-CA 3.3Å; I35-A162 HydrophobicContact CG1-CB 4.08Å; A162-A167 HydrophobicContact CB-CB 4.26Å; A162-A167 WeakPolarHBondContact O-CB 3.23Å; A162-A170 HydrophobicContact CB-CB 3.68Å; A162-R171 PolarHBondContact O-NH2 3.36Å; A162-L174 HydrophobicContact CB-CD1 4.44Å
163	I	98.3	Very high	97.7	Very high	6 Å²	6	53.4 Å²	53.4	3%	0.031	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	161.3	175.3	62.3	167.7	0	0	0	110.7	T33 A34 A76 S132 L134 Q148	T33-I163 CarbonylContact C-O 2.96Å; T33-I163 WeakPolarHBondContact CA-O 3.35Å; A34-I163 HydrophobicContact CB-CD1 4.29Å; A34-I163 HydrophobicContact CB-CG1 3.83Å; A34-I163 PolarHBondContact N-O 3.48Å; A34-I163 PolarHBondContact O-N 3.12Å; A76-I163 HydrophobicContact CB-CB 4.34Å; A76-I163 HydrophobicContact CB-CD1 3.84Å; A76-I163 HydrophobicContact CB-CG1 3.87Å; S132-I163 VanDerWaalsContact O-CD1 3.29Å; S132-I163 WeakPolarHBondContact O-CD1 3.25Å; L134-I163 HydrophobicContact CD1-CD1 4.42Å; L134-I163 HydrophobicContact CD1-CG1 4.04Å; L134-I163 HydrophobicContact CD2-CG2 4.03Å; L134-I163 HydrophobicContact CG-CD1 3.87Å; L134-I163 HydrophobicContact CG-CG1 3.95Å; L134-I163 HydrophobicContact CG-CG2 4.24Å; Q148-I163 HydrophobicContact CG-CG2 4.14Å
164	G	97.3	Very high	97.8	Very high	9 Å²	9	52.8 Å²	52.8	9%	0.093	25%	0.253	C	S	.	.	S	Bend	trans	93.6	-159.5	179.3	0	0	0	0	0	114.3	V28 A76 A167	V28-G164 WeakPolarHBondContact O-CA 3.49Å; A76-G164 VanDerWaalsContact CB-CA 3.47Å; G164-A167 VanDerWaalsContact O-CB 3.24Å; G164-A167 WeakPolarHBondContact O-CB 3.15Å; G164-A167 PolarHBondContact O-N 3.15Å
165	K	95.2	Very high	97.8	Very high	107 Å²	107	57.8 Å²	57.8	47%	0.465	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	139.6	179	-172.6	-179.1	177.8	-170.8	0	109.7	K29 G31 T33 A167	K29-K165 WeakPolarHBondContact O-CA 3.47Å; K29-K165 WeakPolarHBondContact O-CB 3.34Å; K29-K165 PolarHBondContact O-N 3.38Å; G31-K165 WeakPolarHBondContact O-CB 3.48Å; G31-K165 PolarHBondContact O-N 3.05Å; T33-K165 PolarHBondContact OG1-O 3.41Å; K165-A167 PolarHBondContact O-N 2.84Å
166	N	95	Very high	97.8	Very high	78 Å²	78	62.7 Å²	62.7	42%	0.417	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	14.5	178.4	-57.1	-22	0	0	0	115.1	K168 V169 A170 V200	N166-K168 PolarHBondContact O-N 2.79Å; N166-V169 PolarHBondContact O-N 2.84Å; N166-A170 PolarHBondContact O-N 3.1Å; N166-V200 HydrophobicContact CB-CB 3.74Å; N166-V200 HydrophobicContact CB-CG1 3.66Å
167	A	96.9	Very high	97.8	Very high	10 Å²	10	61.1 Å²	61.1	8%	0.083	29%	0.289	C	S	.	.	H	α-helix	trans	-55.8	-28.7	-177.6	0	0	0	0	0	113.8	A162 G164 K165 A170 R171	A162-A167 HydrophobicContact CB-CB 4.26Å; A162-A167 WeakPolarHBondContact O-CB 3.23Å; G164-A167 VanDerWaalsContact O-CB 3.24Å; G164-A167 WeakPolarHBondContact O-CB 3.15Å; G164-A167 PolarHBondContact O-N 3.15Å; K165-A167 PolarHBondContact O-N 2.84Å; A167-A170 PolarHBondContact O-N 2.81Å; A167-R171 VanDerWaalsContact O-CB 3.32Å; A167-R171 WeakPolarHBondContact O-CB 3.32Å; A167-R171 PolarHBondContact O-N 2.93Å
168	K	97.4	Very high	97.8	Very high	140 Å²	140	59.2 Å²	59.2	61%	0.609	28%	0.279	S	S	*	.	H	α-helix	trans	-57.8	-50.2	174.6	-178.2	178.3	172.2	-178.7	0	111.9	N166 R171 E172	N166-K168 PolarHBondContact O-N 2.79Å; K168-R171 PolarHBondContact O-N 3.41Å; K168-E172 WeakPolarHBondContact CE-OE1 3.31Å; K168-E172 WeakPolarHBondContact O-CG 3.48Å; K168-E172 PolarHBondContact O-N 2.81Å
169	V	97.8	Very high	97.8	Very high	67 Å²	67	58.5 Å²	58.5	41%	0.406	28%	0.284	S	S	.	.	H	α-helix	trans	-64.1	-45.2	-179.3	177.6	0	0	0	0	110.6	N166 R171 E172 F173 E199 V200	N166-V169 PolarHBondContact O-N 2.84Å; V169-R171 VanDerWaalsContact C-N 3.29Å; V169-R171 PolarHBondContact O-N 3.14Å; V169-E172 PolarHBondContact O-N 2.65Å; V169-F173 PolarHBondContact O-N 2.97Å; V169-E199 HydrophobicContact CG1-CB 4.34Å; V169-V200 HydrophobicContact CB-CG1 3.77Å; V169-V200 HydrophobicContact CG1-CG1 3.9Å
170	A	97.6	Very high	97.7	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61.2	-38	176.4	0	0	0	0	0	112.1	I35 A162 N166 A167 F173 L174 V200	I35-A170 HydrophobicContact CD1-CB 4.06Å; A162-A170 HydrophobicContact CB-CB 3.68Å; N166-A170 PolarHBondContact O-N 3.1Å; A167-A170 PolarHBondContact O-N 2.81Å; A170-F173 PolarHBondContact O-N 2.99Å; A170-L174 VanDerWaalsContact O-CG 3.3Å; A170-L174 WeakPolarHBondContact O-CG 3.2Å; A170-L174 PolarHBondContact O-N 2.77Å; A170-V200 HydrophobicContact CB-CG1 4.1Å; A170-V200 HydrophobicContact CB-CG2 4.48Å
171	R	98.1	Very high	97.7	Very high	92 Å²	92	68.9 Å²	68.9	35%	0.347	33%	0.332	S	S	.	.	H	α-helix	trans	-69.6	-42.5	177.6	-160.5	-175.5	-49.9	106	6.8	112.5	N161 A162 A167 K168 V169 F173 L174 E175	N161-R171 PolarHBondContact OD1-NE 3.29Å; A162-R171 PolarHBondContact O-NH2 3.36Å; A167-R171 VanDerWaalsContact O-CB 3.32Å; A167-R171 WeakPolarHBondContact O-CB 3.32Å; A167-R171 PolarHBondContact O-N 2.93Å; K168-R171 PolarHBondContact O-N 3.41Å; V169-R171 VanDerWaalsContact C-N 3.29Å; V169-R171 PolarHBondContact O-N 3.14Å; R171-F173 PolarHBondContact O-N 2.58Å; R171-L174 PolarHBondContact O-N 2.97Å; R171-L174 VanDerWaalsContact O-N 3.15Å; R171-E175 WeakPolarHBondContact O-CB 3.21Å; R171-E175 PolarHBondContact O-N 3.23Å
172	E	98.4	Very high	97.6	Very high	78 Å²	78	70.1 Å²	70.1	36%	0.364	34%	0.342	S	S	.	.	H	α-helix	trans	-60.6	-35	174.2	-72.7	171.1	-170.8	0	0	111.8	K168 V169 K176	K168-E172 WeakPolarHBondContact CE-OE1 3.31Å; K168-E172 WeakPolarHBondContact O-CG 3.48Å; K168-E172 PolarHBondContact O-N 2.81Å; V169-E172 PolarHBondContact O-N 2.65Å; E172-K176 WeakPolarHBondContact O-CD 3.34Å; E172-K176 WeakPolarHBondContact O-CG 3.41Å; E172-K176 PolarHBondContact O-N 2.7Å
173	F	98.2	Very high	97.6	Very high	29 Å²	29	70.4 Å²	70.4	13%	0.127	34%	0.344	C	S	.	.	H	α-helix	trans	-66.8	-49	171.7	175.3	-87.3	0	0	0	111.7	V169 A170 R171 E175 K176 N177 L192 K195 A196 E199	V169-F173 PolarHBondContact O-N 2.97Å; A170-F173 PolarHBondContact O-N 2.99Å; R171-F173 PolarHBondContact O-N 2.58Å; F173-E175 VanDerWaalsContact C-N 3.33Å; F173-E175 PolarHBondContact O-N 2.8Å; F173-K176 PolarHBondContact O-N 3.02Å; F173-N177 WeakPolarHBondContact CD2-ND2 3.41Å; F173-N177 HydrophobicContact CE1-CB 4.18Å; F173-N177 WeakPolarHBondContact CE2-ND2 3.1Å; F173-N177 HydrophobicContact CZ-CB 4.13Å; F173-N177 WeakPolarHBondContact O-CB 3.29Å; F173-N177 PolarHBondContact O-N 2.86Å; F173-N177 VanDerWaalsContact O-N 3.14Å; F173-N177 PolarHBondContact O-ND2 2.67Å; F173-L192 HydrophobicContact CE1-CD1 3.91Å; F173-K195 HydrophobicContact CE1-CB 3.74Å; F173-K195 HydrophobicContact CE2-CB 4.42Å; F173-K195 HydrophobicContact CZ-CB 3.45Å; F173-K195 VanDerWaalsContact CZ-CB 3.45Å; F173-K195 HydrophobicContact CZ-CD 4.26Å; F173-K195 HydrophobicContact CZ-CG 4.43Å; F173-A196 VanDerWaalsContact CD1-CA 3.41Å; F173-A196 HydrophobicContact CD1-CB 3.52Å; F173-A196 HydrophobicContact CE1-CB 3.87Å; F173-E199 HydrophobicContact CB-CG 3.9Å; F173-E199 HydrophobicContact CD1-CG 4.41Å; F173-E199 HydrophobicContact CD2-CG 3.47Å; F173-E199 VanDerWaalsContact CD2-CG 3.47Å; F173-E199 HydrophobicContact CE2-CG 4.14Å; F173-E199 HydrophobicContact CG-CG 3.65Å
174	L	98.6	Very high	97.5	Very high	4 Å²	4	72.3 Å²	72.3	2%	0.021	36%	0.361	C	S	.	.	H	α-helix	trans	-59.4	-44.5	179.2	-72.3	167	0	0	0	111.4	I35 V37 A160 A162 A170 R171 K176 N177 Y178 L192 A196	I35-L174 HydrophobicContact CG2-CD1 4.07Å; V37-L174 HydrophobicContact CG2-CD2 4.07Å; A160-L174 HydrophobicContact CB-CB 4.5Å; A160-L174 HydrophobicContact CB-CD1 4.23Å; A160-L174 HydrophobicContact CB-CD2 4.16Å; A162-L174 HydrophobicContact CB-CD1 4.44Å; A170-L174 VanDerWaalsContact O-CG 3.3Å; A170-L174 WeakPolarHBondContact O-CG 3.2Å; A170-L174 PolarHBondContact O-N 2.77Å; R171-L174 PolarHBondContact O-N 2.97Å; R171-L174 VanDerWaalsContact O-N 3.15Å; L174-K176 PolarHBondContact O-N 3.42Å; L174-N177 PolarHBondContact O-N 2.82Å; L174-N177 VanDerWaalsContact O-N 3.16Å; L174-Y178 WeakPolarHBondContact O-CB 3.45Å; L174-Y178 PolarHBondContact O-N 2.71Å; L174-L192 HydrophobicContact CD2-CD1 4.45Å; L174-L192 HydrophobicContact CD2-CD2 4.45Å; L174-L192 HydrophobicContact CD2-CG 4.11Å; L174-A196 HydrophobicContact CD1-CB 4.47Å; L174-A196 HydrophobicContact CD2-CB 3.66Å; L174-A196 HydrophobicContact CG-CB 3.85Å
175	E	98.2	Very high	97.6	Very high	157 Å²	157	76.2 Å²	76.2	73%	0.734	38%	0.38	S	S	*	.	H	α-helix	trans	-58.3	-35.4	178.9	-174.8	174	-167.1	0	0	112.6	R171 F173	R171-E175 WeakPolarHBondContact O-CB 3.21Å; R171-E175 PolarHBondContact O-N 3.23Å; F173-E175 VanDerWaalsContact C-N 3.33Å; F173-E175 PolarHBondContact O-N 2.8Å
176	K	98.1	Very high	97.7	Very high	165 Å²	165	73.9 Å²	73.9	72%	0.717	37%	0.371	S	S	*	.	H	α-helix	trans	-81	-24.6	178.8	-69.7	172.1	-173.8	171.6	0	114.3	E172 F173 L174	E172-K176 WeakPolarHBondContact O-CD 3.34Å; E172-K176 WeakPolarHBondContact O-CG 3.41Å; E172-K176 PolarHBondContact O-N 2.7Å; F173-K176 PolarHBondContact O-N 3.02Å; L174-K176 PolarHBondContact O-N 3.42Å
177	N	98.1	Very high	97.8	Very high	68 Å²	68	75.4 Å²	75.4	36%	0.364	37%	0.371	S	S	.	.	H	α-helix	trans	-119.2	-8.8	-167.5	-66.1	-87.9	0	0	0	113.9	F173 L174 T179 L192	F173-N177 WeakPolarHBondContact CD2-ND2 3.41Å; F173-N177 HydrophobicContact CE1-CB 4.18Å; F173-N177 WeakPolarHBondContact CE2-ND2 3.1Å; F173-N177 HydrophobicContact CZ-CB 4.13Å; F173-N177 WeakPolarHBondContact O-CB 3.29Å; F173-N177 PolarHBondContact O-N 2.86Å; F173-N177 VanDerWaalsContact O-N 3.14Å; F173-N177 PolarHBondContact O-ND2 2.67Å; L174-N177 PolarHBondContact O-N 2.82Å; L174-N177 VanDerWaalsContact O-N 3.16Å; N177-T179 PolarHBondContact O-N 3.5Å; N177-L192 HydrophobicContact CB-CD1 3.69Å
178	Y	98.5	Very high	97.9	Very high	50 Å²	50	75.7 Å²	75.7	20%	0.196	38%	0.375	C	S	.	.			trans	-76	112.9	173.8	-173.3	-76.6	0	0	0	109.3	V37 R38 L159 A160 L174 V183 L192	V37-Y178 HydrophobicContact CG1-CD2 4.25Å; V37-Y178 HydrophobicContact CG1-CE2 4.05Å; R38-Y178 WeakPolarHBondContact O-CE2 3.31Å; R38-Y178 PolarHBondContact O-OH 3.37Å; R38-Y178 VanDerWaalsContact O-OH 3.1Å; L159-Y178 HydrophobicContact CB-CE1 3.99Å; L159-Y178 HydrophobicContact CB-CE2 4.06Å; L159-Y178 HydrophobicContact CD1-CD1 4.45Å; L159-Y178 HydrophobicContact CD1-CE1 3.88Å; L159-Y178 HydrophobicContact CG-CE1 4.43Å; A160-Y178 HydrophobicContact CB-CD2 3.63Å; A160-Y178 HydrophobicContact CB-CE2 3.96Å; L174-Y178 WeakPolarHBondContact O-CB 3.45Å; L174-Y178 PolarHBondContact O-N 2.71Å; Y178-V183 HydrophobicContact CD2-CG1 4Å; Y178-V183 HydrophobicContact CE1-CG2 4.42Å; Y178-V183 HydrophobicContact CE2-CG1 3.78Å; Y178-V183 HydrophobicContact CE2-CG2 4.23Å; Y178-L192 HydrophobicContact CD2-CD2 3.88Å; Y178-L192 HydrophobicContact CG-CD2 4.42Å
179	T	98.1	Very high	97.9	Very high	69 Å²	69	69 Å²	69	42%	0.423	35%	0.346	S	S	.	.			trans	-135.9	159.9	172.2	65	0	0	0	0	109	N177 D181 A182 V183	N177-T179 PolarHBondContact O-N 3.5Å; T179-D181 PolarHBondContact O-N 3.37Å; T179-A182 PolarHBondContact O-N 3.2Å; T179-A182 VanDerWaalsContact O-N 3.07Å; T179-A182 VanDerWaalsContact OG1-CB 3.3Å; T179-A182 WeakPolarHBondContact OG1-CB 3.22Å; T179-A182 PolarHBondContact OG1-N 3.26Å; T179-V183 WeakPolarHBondContact O-CG2 3.5Å; T179-V183 PolarHBondContact O-N 3.16Å
180	E	97	Very high	97.9	Very high	172 Å²	172	65.8 Å²	65.8	80%	0.804	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-40.5	174.8	-65.4	-174.5	169.7	0	0	111.4	V183 A184	E180-V183 CarbonylContact O-C 3.51Å; E180-V183 PolarHBondContact O-N 2.73Å; E180-A184 WeakPolarHBondContact O-CA 3.26Å; E180-A184 WeakPolarHBondContact O-CB 3.37Å; E180-A184 PolarHBondContact O-N 2.48Å
181	D	97.7	Very high	97.9	Very high	145 Å²	145	67.6 Å²	67.6	78%	0.775	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-63.8	-40.6	175.4	-63.6	-34.6	0	0	0	112.6	T179 V183 A184	T179-D181 PolarHBondContact O-N 3.37Å; D181-V183 PolarHBondContact O-N 2.88Å; D181-A184 PolarHBondContact O-N 3.13Å
182	A	97.2	Very high	97.9	Very high	26 Å²	26	63.7 Å²	63.7	22%	0.215	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-66.9	-23.3	-179.1	0	0	0	0	0	112.7	T179 G188 T189	T179-A182 PolarHBondContact O-N 3.2Å; T179-A182 VanDerWaalsContact O-N 3.07Å; T179-A182 VanDerWaalsContact OG1-CB 3.3Å; T179-A182 WeakPolarHBondContact OG1-CB 3.22Å; T179-A182 PolarHBondContact OG1-N 3.26Å; A182-G188 CarbonylContact O-C 3.58Å; A182-G188 VanDerWaalsContact O-CA 3.23Å; A182-G188 WeakPolarHBondContact O-CA 3.39Å; A182-T189 PolarHBondContact O-N 3.25Å
183	V	97.9	Very high	97.9	Very high	7 Å²	7	60 Å²	60	4%	0.042	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-120.6	17.5	-178.2	-51.5	0	0	0	0	113.2	V37 K40 Y178 T179 E180 D181 D185 T189 L192	V37-V183 HydrophobicContact CG1-CG1 4.07Å; K40-V183 PolarHBondContact N-O 3.14Å; K40-V183 VanDerWaalsContact N-O 3.09Å; Y178-V183 HydrophobicContact CD2-CG1 4Å; Y178-V183 HydrophobicContact CE1-CG2 4.42Å; Y178-V183 HydrophobicContact CE2-CG1 3.78Å; Y178-V183 HydrophobicContact CE2-CG2 4.23Å; T179-V183 WeakPolarHBondContact O-CG2 3.5Å; T179-V183 PolarHBondContact O-N 3.16Å; E180-V183 CarbonylContact O-C 3.51Å; E180-V183 PolarHBondContact O-N 2.73Å; D181-V183 PolarHBondContact O-N 2.88Å; V183-D185 PolarHBondContact O-N 2.9Å; V183-T189 WeakPolarHBondContact CA-OG1 3.37Å; V183-T189 PolarHBondContact O-OG1 3.42Å; V183-L192 HydrophobicContact CG1-CD2 3.7Å
184	A	97.1	Very high	97.9	Very high	46 Å²	46	58.6 Å²	58.6	38%	0.38	30%	0.297	S	S	.	.	S	Bend	trans	-64.7	-30.7	-178.1	0	0	0	0	0	112.5	E180 D181	E180-A184 WeakPolarHBondContact O-CA 3.26Å; E180-A184 WeakPolarHBondContact O-CB 3.37Å; E180-A184 PolarHBondContact O-N 2.48Å; D181-A184 PolarHBondContact O-N 3.13Å
185	D	97.5	Very high	97.8	Very high	90 Å²	90	60.2 Å²	60.2	48%	0.481	30%	0.304	S	S	.	.	S	Bend	trans	-131.4	172.5	175.6	66.8	32.6	0	0	0	111.8	V183 Y187 G188 T189	V183-D185 PolarHBondContact O-N 2.9Å; D185-Y187 VanDerWaalsContact C-N 3.34Å; D185-Y187 PolarHBondContact O-N 2.76Å; D185-Y187 PolarHBondContact OD1-N 2.79Å; D185-G188 PolarHBondContact OD1-N 2.74Å; D185-T189 WeakPolarHBondContact O-CB 3.38Å; D185-T189 PolarHBondContact O-N 3.13Å; D185-T189 VanDerWaalsContact O-N 3.11Å; D185-T189 PolarHBondContact O-OG1 2.93Å
186	E	97.6	Very high	97.7	Very high	59 Å²	59	52.8 Å²	52.8	28%	0.276	27%	0.269	S	S	.	.	H	α-helix	trans	-61.3	-42.2	177.9	-179.9	-176.1	153.6	0	0	112.4	G188 T189 V190 V212 R214	E186-G188 PolarHBondContact O-N 2.82Å; E186-T189 PolarHBondContact O-N 3.21Å; E186-V190 HydrophobicContact CG-CG2 4.05Å; E186-V190 WeakPolarHBondContact O-CB 3.29Å; E186-V190 VanDerWaalsContact O-CG2 3.27Å; E186-V190 WeakPolarHBondContact O-CG2 3.34Å; E186-V190 PolarHBondContact O-N 3.12Å; E186-V212 HydrophobicContact CG-CG1 4.06Å; E186-R214 IonicContact OE1-CZ 3.03Å; E186-R214 IonicContact OE1-NE 3.64Å; E186-R214 PolarHBondContact OE1-NE 2.89Å; E186-R214 IonicContact OE1-NH2 2.68Å; E186-R214 PolarHBondContact OE1-NH2 3.31Å; E186-R214 IonicContact OE2-CZ 3.51Å; E186-R214 IonicContact OE2-NE 2.65Å; E186-R214 PolarHBondContact OE2-NE 3.09Å; E186-R214 IonicContact OE2-NH2 2.85Å; E186-R214 PolarHBondContact OE2-NH2 3.1Å
187	Y	97.9	Very high	97.6	Very high	110 Å²	110	44.9 Å²	44.9	43%	0.431	24%	0.235	S	C	.	.	H	α-helix	trans	-62	-47.5	-175.7	177.8	-95.8	0	0	0	111.2	D185 K191 Y239	D185-Y187 VanDerWaalsContact C-N 3.34Å; D185-Y187 PolarHBondContact O-N 2.76Å; D185-Y187 PolarHBondContact OD1-N 2.79Å; Y187-K191 HydrophobicContact CE1-CD 3.99Å; Y187-K191 WeakPolarHBondContact O-CB 3.16Å; Y187-K191 PolarHBondContact O-N 3.23Å; Y187-Y239 HydrophobicContact CD2-CD1 4.31Å; Y187-Y239 AromaticContact CD2-CE1 3.33Å; Y187-Y239 HydrophobicContact CD2-CE1 3.33Å; Y187-Y239 AromaticContact CD2-CZ 3.71Å; Y187-Y239 AromaticContact CE2-CD1 3.96Å; Y187-Y239 HydrophobicContact CE2-CD1 3.96Å; Y187-Y239 AromaticContact CE2-CE1 3.42Å; Y187-Y239 HydrophobicContact CE2-CE1 3.42Å; Y187-Y239 VanDerWaalsContact CE2-CE1 3.42Å; Y187-Y239 HydrophobicContact CG-CE1 4.12Å
188	G	98.1	Very high	97.5	Very high	15 Å²	15	42.9 Å²	42.9	16%	0.155	22%	0.223	C	C	.	.	H	α-helix	trans	-60.1	-46.1	174.3	0	0	0	0	0	112.2	A182 D185 E186 V190 K191 L192	A182-G188 CarbonylContact O-C 3.58Å; A182-G188 VanDerWaalsContact O-CA 3.23Å; A182-G188 WeakPolarHBondContact O-CA 3.39Å; D185-G188 PolarHBondContact OD1-N 2.74Å; E186-G188 PolarHBondContact O-N 2.82Å; G188-V190 PolarHBondContact O-N 3.49Å; G188-K191 PolarHBondContact O-N 3.45Å; G188-L192 WeakPolarHBondContact O-CB 3.44Å; G188-L192 PolarHBondContact O-N 2.85Å
189	T	98.6	Very high	97.2	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.2	-46.8	-179.9	-51.6	0	0	0	0	111.9	V37 G39 V44 A182 V183 D185 E186 L192 A193	V37-T189 HydrophobicContact CB-CG2 4.08Å; V37-T189 HydrophobicContact CG1-CG2 3.68Å; G39-T189 WeakPolarHBondContact CA-OG1 3.22Å; V44-T189 HydrophobicContact CB-CG2 4.31Å; V44-T189 HydrophobicContact CG2-CG2 3.57Å; A182-T189 PolarHBondContact O-N 3.25Å; V183-T189 WeakPolarHBondContact CA-OG1 3.37Å; V183-T189 PolarHBondContact O-OG1 3.42Å; D185-T189 WeakPolarHBondContact O-CB 3.38Å; D185-T189 PolarHBondContact O-N 3.13Å; D185-T189 VanDerWaalsContact O-N 3.11Å; D185-T189 PolarHBondContact O-OG1 2.93Å; E186-T189 PolarHBondContact O-N 3.21Å; T189-L192 PolarHBondContact O-N 2.88Å; T189-A193 PolarHBondContact O-N 3.29Å; T189-A193 VanDerWaalsContact O-N 3.1Å
190	V	98.3	Very high	96.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.4	-46.5	176.2	173.3	0	0	0	0	110.4	V44 E186 G188 L192 A193 V194 L210 V212 L231 Y239	V44-V190 HydrophobicContact CG1-CG2 4.24Å; V44-V190 HydrophobicContact CG2-CG2 3.79Å; E186-V190 HydrophobicContact CG-CG2 4.05Å; E186-V190 WeakPolarHBondContact O-CB 3.29Å; E186-V190 VanDerWaalsContact O-CG2 3.27Å; E186-V190 WeakPolarHBondContact O-CG2 3.34Å; E186-V190 PolarHBondContact O-N 3.12Å; G188-V190 PolarHBondContact O-N 3.49Å; V190-L192 VanDerWaalsContact C-N 3.32Å; V190-L192 PolarHBondContact O-N 3.18Å; V190-A193 PolarHBondContact O-N 3.41Å; V190-V194 HydrophobicContact CG1-CG2 4.29Å; V190-V194 WeakPolarHBondContact O-CG2 3.46Å; V190-V194 PolarHBondContact O-N 3.02Å; V190-L210 HydrophobicContact CG1-CD1 3.88Å; V190-L210 HydrophobicContact CG1-CD2 4.15Å; V190-V212 HydrophobicContact CG2-CG2 3.55Å; V190-L231 HydrophobicContact CG1-CD2 4.43Å; V190-Y239 HydrophobicContact CB-CE1 3.87Å; V190-Y239 HydrophobicContact CB-CE2 4.47Å; V190-Y239 HydrophobicContact CG1-CD1 3.9Å; V190-Y239 HydrophobicContact CG1-CD2 3.89Å; V190-Y239 HydrophobicContact CG1-CE1 3.62Å; V190-Y239 HydrophobicContact CG1-CE2 3.65Å; V190-Y239 HydrophobicContact CG1-CG 4.03Å
191	K	97.6	Very high	96.4	Very high	38 Å²	38	34.4 Å²	34.4	17%	0.165	18%	0.183	C	C	.	.	H	α-helix	trans	-59.3	-41.6	178.2	-178.4	-179.9	175.8	-174.9	0	111.9	Y187 G188 V194 K195 Y239 I243 E246	Y187-K191 HydrophobicContact CE1-CD 3.99Å; Y187-K191 WeakPolarHBondContact O-CB 3.16Å; Y187-K191 PolarHBondContact O-N 3.23Å; G188-K191 PolarHBondContact O-N 3.45Å; K191-V194 PolarHBondContact O-N 3.47Å; K191-K195 WeakPolarHBondContact O-CB 3.4Å; K191-K195 WeakPolarHBondContact O-CG 3.4Å; K191-K195 PolarHBondContact O-N 3.27Å; K191-Y239 HydrophobicContact CB-CD1 4.23Å; K191-Y239 HydrophobicContact CB-CE1 4.42Å; K191-I243 HydrophobicContact CG-CD1 4.11Å; K191-I243 HydrophobicContact CG-CG1 4.01Å; K191-E246 VanDerWaalsContact CE-OE1 3.31Å; K191-E246 WeakPolarHBondContact CE-OE1 3.11Å; K191-E246 WeakPolarHBondContact CE-OE2 3.06Å; K191-E246 IonicContact NZ-OE1 2.75Å; K191-E246 PolarHBondContact NZ-OE1 3.17Å; K191-E246 IonicContact NZ-OE2 3.48Å; K191-E246 PolarHBondContact NZ-OE2 2.97Å
192	L	98.2	Very high	95.2	Very high	10 Å²	10	37.1 Å²	37.1	5%	0.052	19%	0.191	C	C	.	.	H	α-helix	trans	-62.6	-45.9	176	-179.1	63.4	0	0	0	111.2	V37 F173 L174 N177 Y178 V183 G188 T189 V190 V194 K195 A196	V37-L192 HydrophobicContact CG1-CD2 4.07Å; F173-L192 HydrophobicContact CE1-CD1 3.91Å; L174-L192 HydrophobicContact CD2-CD1 4.45Å; L174-L192 HydrophobicContact CD2-CD2 4.45Å; L174-L192 HydrophobicContact CD2-CG 4.11Å; N177-L192 HydrophobicContact CB-CD1 3.69Å; Y178-L192 HydrophobicContact CD2-CD2 3.88Å; Y178-L192 HydrophobicContact CG-CD2 4.42Å; V183-L192 HydrophobicContact CG1-CD2 3.7Å; G188-L192 WeakPolarHBondContact O-CB 3.44Å; G188-L192 PolarHBondContact O-N 2.85Å; T189-L192 PolarHBondContact O-N 2.88Å; V190-L192 VanDerWaalsContact C-N 3.32Å; V190-L192 PolarHBondContact O-N 3.18Å; L192-V194 PolarHBondContact O-N 3.1Å; L192-K195 PolarHBondContact O-N 2.72Å; L192-A196 WeakPolarHBondContact O-CB 3.29Å; L192-A196 PolarHBondContact O-N 3.03Å
193	A	98.2	Very high	93.7	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.8	-41.9	177.1	0	0	0	0	0	112.4	V37 V44 C46 T189 V190 A196 L197	V37-A193 HydrophobicContact CB-CB 4.46Å; V37-A193 HydrophobicContact CG2-CB 3.74Å; V44-A193 HydrophobicContact CB-CB 4.45Å; V44-A193 HydrophobicContact CG1-CB 3.85Å; C46-A193 HydrophobicContact CB-CB 3.99Å; T189-A193 PolarHBondContact O-N 3.29Å; T189-A193 VanDerWaalsContact O-N 3.1Å; V190-A193 PolarHBondContact O-N 3.41Å; A193-A196 PolarHBondContact O-N 3.02Å; A193-L197 PolarHBondContact O-N 2.89Å; A193-L197 VanDerWaalsContact O-N 3.12Å
194	V	97	Very high	92.9	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66.9	-46.6	176.5	177.6	0	0	0	0	111	V190 K191 L192 A196 L197 M198 M208 L210 V240 I243	V190-V194 HydrophobicContact CG1-CG2 4.29Å; V190-V194 WeakPolarHBondContact O-CG2 3.46Å; V190-V194 PolarHBondContact O-N 3.02Å; K191-V194 PolarHBondContact O-N 3.47Å; L192-V194 PolarHBondContact O-N 3.1Å; V194-A196 VanDerWaalsContact C-N 3.28Å; V194-A196 PolarHBondContact O-N 2.9Å; V194-L197 PolarHBondContact O-N 2.92Å; V194-L197 VanDerWaalsContact O-N 3.13Å; V194-M198 HydrophobicContact CG1-CG 4.25Å; V194-M198 HydrophobicContact CG1-SD 3.83Å; V194-M198 VanDerWaalsContact O-CG 3.31Å; V194-M198 WeakPolarHBondContact O-CG 3.35Å; V194-M198 PolarHBondContact O-N 2.75Å; V194-M208 HydrophobicContact CG1-CE 4.47Å; V194-M208 HydrophobicContact CG1-SD 4.17Å; V194-L210 HydrophobicContact CG2-CD1 3.41Å; V194-L210 VanDerWaalsContact CG2-CD1 3.41Å; V194-V240 HydrophobicContact CG1-CG2 3.96Å; V194-I243 HydrophobicContact CB-CD1 3.7Å; V194-I243 HydrophobicContact CG1-CD1 3.45Å; V194-I243 VanDerWaalsContact CG1-CD1 3.45Å
195	K	96.3	Very high	92.4	Very high	38 Å²	38	37.2 Å²	37.2	17%	0.165	19%	0.192	C	C	.	.	H	α-helix	trans	-56.4	-44.8	176.1	-76.9	-171	176	-172.3	0	111	F173 K191 L192 L197 M198 E199 I243 E246 R247	F173-K195 HydrophobicContact CE1-CB 3.74Å; F173-K195 HydrophobicContact CE2-CB 4.42Å; F173-K195 HydrophobicContact CZ-CB 3.45Å; F173-K195 VanDerWaalsContact CZ-CB 3.45Å; F173-K195 HydrophobicContact CZ-CD 4.26Å; F173-K195 HydrophobicContact CZ-CG 4.43Å; K191-K195 WeakPolarHBondContact O-CB 3.4Å; K191-K195 WeakPolarHBondContact O-CG 3.4Å; K191-K195 PolarHBondContact O-N 3.27Å; L192-K195 PolarHBondContact O-N 2.72Å; K195-L197 VanDerWaalsContact C-N 3.32Å; K195-L197 PolarHBondContact O-N 3.43Å; K195-M198 PolarHBondContact O-N 2.82Å; K195-E199 PolarHBondContact O-N 2.75Å; K195-I243 HydrophobicContact CD-CG1 4.47Å; K195-I243 HydrophobicContact CD-CG2 4.44Å; K195-I243 HydrophobicContact CG-CB 4.4Å; K195-I243 HydrophobicContact CG-CD1 3.69Å; K195-I243 HydrophobicContact CG-CG1 3.79Å; K195-I243 HydrophobicContact CG-CG2 3.7Å; K195-E246 WeakPolarHBondContact CE-OE2 3.43Å; K195-E246 IonicContact NZ-OE2 3.79Å; K195-E246 PolarHBondContact NZ-OE2 2.85Å; K195-R247 PolarHBondContact O-NH2 2.68Å
196	A	97.2	Very high	91.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.6	-36.9	178.8	0	0	0	0	0	112.8	I35 F173 L174 L192 A193 V194	I35-A196 HydrophobicContact CD1-CB 3.58Å; I35-A196 HydrophobicContact CG2-CB 4.41Å; F173-A196 VanDerWaalsContact CD1-CA 3.41Å; F173-A196 HydrophobicContact CD1-CB 3.52Å; F173-A196 HydrophobicContact CE1-CB 3.87Å; L174-A196 HydrophobicContact CD1-CB 4.47Å; L174-A196 HydrophobicContact CD2-CB 3.66Å; L174-A196 HydrophobicContact CG-CB 3.85Å; L192-A196 WeakPolarHBondContact O-CB 3.29Å; L192-A196 PolarHBondContact O-N 3.03Å; A193-A196 PolarHBondContact O-N 3.02Å; V194-A196 VanDerWaalsContact C-N 3.28Å; V194-A196 PolarHBondContact O-N 2.9Å
197	L	96.1	Very high	91.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-72.9	-36.5	176.6	-168.3	62.2	0	0	0	111.7	T33 I35 C46 E48 A193 V194 K195 E199 V200 V201 M208	T33-L197 HydrophobicContact CG2-CD1 4.2Å; I35-L197 VanDerWaalsContact CD1-CA 3.5Å; I35-L197 HydrophobicContact CD1-CB 3.79Å; I35-L197 HydrophobicContact CD1-CD1 4.06Å; I35-L197 HydrophobicContact CG1-CD1 4.38Å; C46-L197 WeakPolarHBondContact SG-CD2 3.14Å; E48-L197 HydrophobicContact CB-CD1 4.26Å; A193-L197 PolarHBondContact O-N 2.89Å; A193-L197 VanDerWaalsContact O-N 3.12Å; V194-L197 PolarHBondContact O-N 2.92Å; V194-L197 VanDerWaalsContact O-N 3.13Å; K195-L197 VanDerWaalsContact C-N 3.32Å; K195-L197 PolarHBondContact O-N 3.43Å; L197-E199 PolarHBondContact O-N 2.9Å; L197-V200 HydrophobicContact CD1-CG2 4.18Å; L197-V200 VanDerWaalsContact O-CG2 3.28Å; L197-V200 WeakPolarHBondContact O-CG2 3.46Å; L197-V200 PolarHBondContact O-N 3.09Å; L197-V201 HydrophobicContact CD1-CG2 3.73Å; L197-V201 HydrophobicContact CG-CG2 3.85Å; L197-V201 PolarHBondContact O-N 2.76Å; L197-M208 HydrophobicContact CD2-CB 4.41Å; L197-M208 HydrophobicContact CD2-CE 4.44Å; L197-M208 HydrophobicContact CD2-CG 3.79Å; L197-M208 HydrophobicContact CD2-SD 4.13Å
198	M	94.6	Very high	91.2	Very high	26 Å²	26	35.6 Å²	35.6	13%	0.128	18%	0.181	C	C	.	.	H	α-helix	trans	-67.1	-16.6	176.5	-71	179.4	72.7	0	0	113.7	V194 K195 V200 M208 V240 I243 E244	V194-M198 HydrophobicContact CG1-CG 4.25Å; V194-M198 HydrophobicContact CG1-SD 3.83Å; V194-M198 VanDerWaalsContact O-CG 3.31Å; V194-M198 WeakPolarHBondContact O-CG 3.35Å; V194-M198 PolarHBondContact O-N 2.75Å; K195-M198 PolarHBondContact O-N 2.82Å; M198-V200 PolarHBondContact O-N 3.07Å; M198-M208 HydrophobicContact CG-CE 3.61Å; M198-V240 HydrophobicContact CE-CG1 4.11Å; M198-V240 HydrophobicContact SD-CG1 4.35Å; M198-V240 HydrophobicContact SD-CG2 4.33Å; M198-I243 HydrophobicContact CE-CG2 4.15Å; M198-I243 HydrophobicContact SD-CB 4.26Å; M198-I243 HydrophobicContact SD-CD1 4.29Å; M198-I243 HydrophobicContact SD-CG2 3.76Å; M198-E244 HydrophobicContact CE-CG 3.81Å
199	E	93.6	Very high	91.1	Very high	80 Å²	80	35.9 Å²	35.9	37%	0.374	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-21.5	169.7	-66.7	-53.1	113.7	0	0	112.9	V169 F173 K195 L197 R247	V169-E199 HydrophobicContact CG1-CB 4.34Å; F173-E199 HydrophobicContact CB-CG 3.9Å; F173-E199 HydrophobicContact CD1-CG 4.41Å; F173-E199 HydrophobicContact CD2-CG 3.47Å; F173-E199 VanDerWaalsContact CD2-CG 3.47Å; F173-E199 HydrophobicContact CE2-CG 4.14Å; F173-E199 HydrophobicContact CG-CG 3.65Å; K195-E199 PolarHBondContact O-N 2.75Å; L197-E199 PolarHBondContact O-N 2.9Å; E199-R247 IonicContact OE1-CZ 2.57Å; E199-R247 VanDerWaalsContact OE1-CZ 3.32Å; E199-R247 IonicContact OE1-NH1 3.32Å; E199-R247 PolarHBondContact OE1-NH1 3.01Å; E199-R247 IonicContact OE1-NH2 2.79Å; E199-R247 PolarHBondContact OE1-NH2 3.49Å
200	V	92.2	Very high	91	Very high	22 Å²	22	36 Å²	36	13%	0.133	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.9	-16.9	-172	-60.2	0	0	0	0	114.5	T33 N166 V169 A170 L197 M198	T33-V200 HydrophobicContact CG2-CG2 4.02Å; N166-V200 HydrophobicContact CB-CB 3.74Å; N166-V200 HydrophobicContact CB-CG1 3.66Å; V169-V200 HydrophobicContact CB-CG1 3.77Å; V169-V200 HydrophobicContact CG1-CG1 3.9Å; A170-V200 HydrophobicContact CB-CG1 4.1Å; A170-V200 HydrophobicContact CB-CG2 4.48Å; L197-V200 HydrophobicContact CD1-CG2 4.18Å; L197-V200 VanDerWaalsContact O-CG2 3.28Å; L197-V200 WeakPolarHBondContact O-CG2 3.46Å; L197-V200 PolarHBondContact O-N 3.09Å; M198-V200 PolarHBondContact O-N 3.07Å
201	V	86	Confident	91	Very high	11 Å²	11	36 Å²	36	7%	0.067	18%	0.179	C	C	.	.			trans	-112.3	121.1	176.6	-174.6	0	0	0	0	109.3	E48 L197 S203	E48-V201 HydrophobicContact CB-CG2 3.86Å; E48-V201 HydrophobicContact CG-CG1 4.26Å; E48-V201 HydrophobicContact CG-CG2 3.64Å; L197-V201 HydrophobicContact CD1-CG2 3.73Å; L197-V201 HydrophobicContact CG-CG2 3.85Å; L197-V201 PolarHBondContact O-N 2.76Å; V201-S203 PolarHBondContact O-N 3.06Å
202	Q	73.1	Confident	91	Very high	202 Å²	202	34.1 Å²	34.1	94%	0.944	17%	0.171	S	C	*	.			trans	-77.5	28	177.9	-71.7	-174.7	-17.6	0	0	113.5
203	S	65.2	Low	91.1	Very high	44 Å²	44	33.7 Å²	33.7	31%	0.308	17%	0.168	S	C	.	.			trans	-149.9	126	-163.7	-43.6	0	0	0	0	112.5	V201	V201-S203 PolarHBondContact O-N 3.06Å
204	G	80.4	Confident	91	Very high	28 Å²	28	35.9 Å²	35.9	29%	0.289	18%	0.177	S	C	.	.			trans	-63.6	-168.6	-175	0	0	0	0	0	114.8	K206 Y207	G204-K206 PolarHBondContact O-N 2.92Å; G204-Y207 PolarHBondContact O-N 3.27Å
205	A	86.1	Confident	91	Very high	8 Å²	8	39.1 Å²	39.1	7%	0.066	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-46.6	-26.5	-165.1	0	0	0	0	0	117.3	Y207 M208 F233 I236 Q237 V240	A205-Y207 PolarHBondContact O-N 3.24Å; A205-M208 PolarHBondContact O-N 3.26Å; A205-F233 HydrophobicContact CB-CD2 4.19Å; A205-F233 HydrophobicContact CB-CE2 3.92Å; A205-I236 HydrophobicContact CB-CB 4.01Å; A205-I236 HydrophobicContact CB-CG2 3.59Å; A205-Q237 HydrophobicContact CB-CB 3.86Å; A205-V240 HydrophobicContact CB-CG2 4.15Å
206	K	87.5	Confident	90.9	Very high	141 Å²	141	43.5 Å²	43.5	61%	0.613	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-61.9	-27.9	178.2	-175	176.2	178.6	-178.9	0	113.6	G204 F233	G204-K206 PolarHBondContact O-N 2.92Å; K206-F233 HydrophobicContact CB-CE2 3.93Å
207	Y	88.9	Confident	90.7	Very high	76 Å²	76	46.7 Å²	46.7	30%	0.298	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-103.5	19.7	-175.2	-55.6	-80.6	0	0	0	112.3	K49 A51 G204 A205	K49-Y207 PolarHBondContact N-O 3.27Å; A51-Y207 HydrophobicContact CB-CD1 4.38Å; A51-Y207 HydrophobicContact CB-CE1 3.78Å; G204-Y207 PolarHBondContact O-N 3.27Å; A205-Y207 PolarHBondContact O-N 3.24Å
208	M	92.9	Very high	90.4	Very high	9 Å²	9	49.3 Å²	49.3	4%	0.044	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	142.4	177.5	-58.7	-176.6	-173.1	0	0	109.6	V47 V194 L197 M198 A205 I236 V240	V47-M208 WeakPolarHBondContact O-CA 3.14Å; V194-M208 HydrophobicContact CG1-CE 4.47Å; V194-M208 HydrophobicContact CG1-SD 4.17Å; L197-M208 HydrophobicContact CD2-CB 4.41Å; L197-M208 HydrophobicContact CD2-CE 4.44Å; L197-M208 HydrophobicContact CD2-CG 3.79Å; L197-M208 HydrophobicContact CD2-SD 4.13Å; M198-M208 HydrophobicContact CG-CE 3.61Å; A205-M208 PolarHBondContact O-N 3.26Å; M208-I236 HydrophobicContact CB-CG2 4.1Å; M208-I236 HydrophobicContact SD-CG2 4.17Å; M208-V240 HydrophobicContact CE-CG2 4.21Å; M208-V240 HydrophobicContact SD-CG2 4.17Å
209	E	94.6	Very high	90.2	Very high	21 Å²	21	53.2 Å²	53.2	10%	0.098	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	125.7	161.8	169.8	-177.8	-145.2	0	0	106.1	V47 R62 K63 I64 M230	V47-E209 HydrophobicContact CG2-CB 3.59Å; V47-E209 HydrophobicContact CG2-CG 4.05Å; V47-E209 WeakPolarHBondContact CG2-O 3.47Å; V47-E209 PolarHBondContact N-O 2.91Å; V47-E209 PolarHBondContact O-N 2.94Å; R62-E209 WeakPolarHBondContact CB-OE1 3.4Å; K63-E209 PolarHBondContact N-OE2 3.11Å; I64-E209 HydrophobicContact CD1-CG 3.94Å; I64-E209 HydrophobicContact CG1-CG 4.14Å; I64-E209 PolarHBondContact N-OE2 3.4Å; E209-M230 HydrophobicContact CG-CE 3.46Å; E209-M230 VanDerWaalsContact CG-CE 3.46Å; E209-M230 WeakPolarHBondContact OE1-CE 3.33Å
210	L	96.9	Very high	90	Very high	1 Å²	1	56 Å²	56	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	134.3	-173	-160.1	161.6	0	0	0	109.3	V44 L45 C46 V190 V194 V212 L231 I236	V44-L210 HydrophobicContact CG1-CD2 3.82Å; V44-L210 HydrophobicContact CG1-CG 4.37Å; L45-L210 CarbonylContact O-C 3.5Å; L45-L210 WeakPolarHBondContact O-CA 3.36Å; C46-L210 HydrophobicContact CB-CD1 4.39Å; C46-L210 HydrophobicContact CB-CG 4.19Å; V190-L210 HydrophobicContact CG1-CD1 3.88Å; V190-L210 HydrophobicContact CG1-CD2 4.15Å; V194-L210 HydrophobicContact CG2-CD1 3.41Å; V194-L210 VanDerWaalsContact CG2-CD1 3.41Å; L210-V212 HydrophobicContact CD2-CG2 3.86Å; L210-L231 HydrophobicContact CB-CB 4.46Å; L210-L231 HydrophobicContact CD2-CD1 3.79Å; L210-L231 HydrophobicContact CD2-CD2 3.82Å; L210-L231 HydrophobicContact CD2-CG 4.22Å; L210-L231 PolarHBondContact O-N 3.23Å; L210-I236 HydrophobicContact CB-CD1 3.92Å; L210-I236 HydrophobicContact CB-CG1 4.11Å
211	A	98.2	Very high	89.7	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	146.8	175.5	0	0	0	0	0	111.4	V44 L45 I64 W228 Q229 M230	V44-A211 WeakPolarHBondContact CA-O 3.43Å; L45-A211 PolarHBondContact N-O 3.31Å; L45-A211 PolarHBondContact O-N 3.32Å; I64-A211 HydrophobicContact CD1-CB 3.91Å; I64-A211 HydrophobicContact CG2-CB 4.05Å; A211-W228 HydrophobicContact CB-CH2 3.17Å; A211-W228 HydrophobicContact CB-CZ2 3.41Å; A211-W228 VanDerWaalsContact CB-CZ2 3.41Å; A211-W228 HydrophobicContact CB-CZ3 3.83Å; A211-Q229 CarbonylContact C-O 3.57Å; A211-Q229 VanDerWaalsContact CA-O 3.26Å; A211-Q229 WeakPolarHBondContact CA-O 3.38Å; A211-M230 HydrophobicContact CB-CE 4.15Å; A211-M230 HydrophobicContact CB-SD 3.49Å; A211-M230 WeakPolarHBondContact CB-SD 3.38Å
212	V	98.6	Very high	89.5	Confident	0 Å²	0	65 Å²	65	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	131.5	178	-178	0	0	0	0	107.8	C42 V44 E186 V190 L210 R214 Q229 L231	C42-V212 HydrophobicContact CB-CG1 4.01Å; V44-V212 HydrophobicContact CG1-CG2 4.4Å; V44-V212 HydrophobicContact CG2-CG1 4.47Å; V44-V212 HydrophobicContact CG2-CG2 4.13Å; E186-V212 HydrophobicContact CG-CG1 4.06Å; V190-V212 HydrophobicContact CG2-CG2 3.55Å; L210-V212 HydrophobicContact CD2-CG2 3.86Å; V212-R214 HydrophobicContact CG1-CG 4.03Å; V212-Q229 PolarHBondContact N-O 3.2Å; V212-Q229 PolarHBondContact O-N 3.26Å; V212-L231 HydrophobicContact CB-CD1 4.14Å; V212-L231 HydrophobicContact CG2-CD1 3.53Å
213	M	98.6	Very high	90.3	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	133.3	165.2	-166.7	175.6	-77.9	0	0	108.3	C42 V43 L66 H70 A72 F138 V226 D227 W228	C42-M213 CarbonylContact C-O 3.58Å; C42-M213 WeakPolarHBondContact CA-O 3.41Å; C42-M213 WeakPolarHBondContact CB-O 3.48Å; V43-M213 HydrophobicContact CG2-CB 3.68Å; V43-M213 PolarHBondContact N-O 2.79Å; V43-M213 PolarHBondContact O-N 3.21Å; L66-M213 HydrophobicContact CD2-CE 3.92Å; H70-M213 VanDerWaalsContact O-SD 3.41Å; A72-M213 HydrophobicContact CB-CE 4.05Å; F138-M213 HydrophobicContact CD2-CG 4.08Å; F138-M213 HydrophobicContact CD2-SD 4.15Å; F138-M213 HydrophobicContact CE2-CB 4.44Å; F138-M213 HydrophobicContact CE2-CG 4.27Å; M213-V226 HydrophobicContact CG-CB 3.93Å; M213-V226 HydrophobicContact CG-CG1 4.14Å; M213-V226 HydrophobicContact CG-CG2 4.34Å; M213-V226 HydrophobicContact SD-CB 4.21Å; M213-V226 HydrophobicContact SD-CG1 4.02Å; M213-V226 HydrophobicContact SD-CG2 4.25Å; M213-D227 CarbonylContact C-O 3.49Å; M213-D227 WeakPolarHBondContact CA-O 3.3Å; M213-W228 HydrophobicContact CB-CE3 3.76Å; M213-W228 HydrophobicContact CB-CZ3 4.07Å; M213-W228 HydrophobicContact CE-CD2 4.38Å; M213-W228 HydrophobicContact CE-CE3 3.62Å; M213-W228 HydrophobicContact CE-CZ3 4.07Å; M213-W228 HydrophobicContact CG-CE3 4.25Å
214	R	98	Very high	91.6	Very high	47 Å²	47	61.4 Å²	61.4	18%	0.177	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	144.1	-179.8	-54.1	171.5	-175.8	96.5	6.5	109.6	C42 E186 V212 V226 D227 Q229	C42-R214 HydrophobicContact CB-CG 4.5Å; E186-R214 IonicContact OE1-CZ 3.03Å; E186-R214 IonicContact OE1-NE 3.64Å; E186-R214 PolarHBondContact OE1-NE 2.89Å; E186-R214 IonicContact OE1-NH2 2.68Å; E186-R214 PolarHBondContact OE1-NH2 3.31Å; E186-R214 IonicContact OE2-CZ 3.51Å; E186-R214 IonicContact OE2-NE 2.65Å; E186-R214 PolarHBondContact OE2-NE 3.09Å; E186-R214 IonicContact OE2-NH2 2.85Å; E186-R214 PolarHBondContact OE2-NH2 3.1Å; V212-R214 HydrophobicContact CG1-CG 4.03Å; R214-V226 CarbonylContact O-C 3.53Å; R214-V226 VanDerWaalsContact O-CA 3.22Å; R214-V226 WeakPolarHBondContact O-CA 3.45Å; R214-V226 WeakPolarHBondContact O-CB 3.45Å; R214-D227 HydrophobicContact CB-CB 4.32Å; R214-D227 IonicContact CZ-OD2 2.7Å; R214-D227 PolarHBondContact N-O 3.45Å; R214-D227 IonicContact NH1-OD2 3.69Å; R214-D227 PolarHBondContact NH1-OD2 3.19Å; R214-D227 PolarHBondContact O-N 3.27Å; R214-Q229 VanDerWaalsContact CZ-OE1 3.28Å
215	W	96.4	Very high	92.3	Very high	68 Å²	68	61.1 Å²	61.1	26%	0.258	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	136.1	167.9	178.8	-116.3	0	0	0	110.4	D41 F138 N139 Q140 G142 A217 F225	D41-W215 PolarHBondContact O-N 3.02Å; D41-W215 VanDerWaalsContact O-N 3.09Å; F138-W215 HydrophobicContact CB-CE3 3.8Å; F138-W215 HydrophobicContact CB-CZ3 4.1Å; F138-W215 HydrophobicContact CD1-CB 3.93Å; F138-W215 HydrophobicContact CD1-CD2 4.4Å; F138-W215 AromaticContact CD1-CE3 3.89Å; F138-W215 HydrophobicContact CD1-CE3 3.89Å; F138-W215 HydrophobicContact CD1-CG 4.45Å; F138-W215 HydrophobicContact CE1-CB 3.64Å; F138-W215 HydrophobicContact CG-CB 4.47Å; F138-W215 AromaticContact CG-CE3 3.94Å; F138-W215 HydrophobicContact CG-CE3 3.94Å; F138-W215 HydrophobicContact CZ-CB 3.96Å; N139-W215 WeakPolarHBondContact O-CZ3 3.23Å; Q140-W215 WeakPolarHBondContact O-CH2 3.44Å; G142-W215 VanDerWaalsContact CA-CH2 3.46Å; G142-W215 VanDerWaalsContact CA-CZ3 3.41Å; W215-A217 HydrophobicContact CZ2-CB 4.48Å; W215-F225 HydrophobicContact CE3-CD2 4.07Å; W215-F225 HydrophobicContact CH2-CB 3.9Å; W215-F225 HydrophobicContact CH2-CD2 4.03Å; W215-F225 HydrophobicContact CH2-CG 4.25Å; W215-F225 HydrophobicContact CZ3-CB 3.88Å; W215-F225 AromaticContact CZ3-CD2 3.31Å; W215-F225 HydrophobicContact CZ3-CD2 3.31Å; W215-F225 HydrophobicContact CZ3-CE2 4.13Å; W215-F225 AromaticContact CZ3-CG 3.94Å; W215-F225 HydrophobicContact CZ3-CG 3.94Å
216	K	94.6	Very high	92.9	Very high	130 Å²	130	61.6 Å²	61.6	57%	0.565	35%	0.346	S	S	*	.			trans	-137.7	98.7	172.6	-178.9	-173.7	175.9	-175.4	0	108.3	F225	K216-F225 CarbonylContact C-O 3.45Å; K216-F225 PolarHBondContact N-O 3.46Å; K216-F225 CarbonylContact O-C 3.1Å; K216-F225 WeakPolarHBondContact O-CA 3.06Å
217	A	91.5	Very high	93.3	Very high	66 Å²	66	58.3 Å²	58.3	55%	0.545	34%	0.335	S	S	.	.			trans	-51.2	125.9	-179.1	0	0	0	0	0	111.4	W215	W215-A217 HydrophobicContact CZ2-CB 4.48Å
218	P	91.2	Very high	93.7	Very high	56 Å²	56	57.6 Å²	57.6	36%	0.364	33%	0.332	S	S	.	.			trans	-69.6	140.1	-178.2	28.3	-32.9	0	0	0	109.9	E223 F225	P218-E223 HydrophobicContact CB-CB 4.22Å; P218-F225 HydrophobicContact CB-CB 4.26Å; P218-F225 HydrophobicContact CG-CB 4.01Å
219	S	90.5	Very high	93.9	Very high	107 Å²	107	60.4 Å²	60.4	75%	0.748	35%	0.345	S	S	*	.	S	Bend	trans	-81.4	-25.2	178	-60.7	0	0	0	0	111.9	E223	S219-E223 WeakPolarHBondContact CB-OE2 3.44Å; S219-E223 PolarHBondContact N-OE2 3.07Å; S219-E223 VanDerWaalsContact N-OE2 3.1Å
220	K	89.3	Confident	94	Very high	139 Å²	139	62 Å²	62	60%	0.604	35%	0.353	S	S	*	.	S	Bend	trans	-141.6	154.7	177.5	-62.7	176.9	-174.3	170.3	0	110.7	G222 E223	K220-G222 PolarHBondContact O-N 3.07Å; K220-E223 HydrophobicContact CB-CG 4.3Å; K220-E223 PolarHBondContact N-OE2 2.91Å; K220-E223 PolarHBondContact O-N 3.23Å
221	P	84.5	Confident	94	Very high	137 Å²	137	63 Å²	63	89%	0.89	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	134.9	171.3	-24.9	34.4	0	0	0	111.6
222	G	83.4	Confident	93.8	Very high	86 Å²	86	69.6 Å²	69.6	89%	0.887	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.8	-9.7	179.2	0	0	0	0	0	115.9	K220	K220-G222 PolarHBondContact O-N 3.07Å
223	E	89.5	Confident	93.5	Very high	78 Å²	78	75 Å²	75	36%	0.364	41%	0.412	S	S	.	.	S	Bend	trans	-72.1	150.4	171.9	-71.7	-178.8	-179.4	0	0	111.8	P218 S219 K220 F225	P218-E223 HydrophobicContact CB-CB 4.22Å; S219-E223 WeakPolarHBondContact CB-OE2 3.44Å; S219-E223 PolarHBondContact N-OE2 3.07Å; S219-E223 VanDerWaalsContact N-OE2 3.1Å; K220-E223 HydrophobicContact CB-CG 4.3Å; K220-E223 PolarHBondContact N-OE2 2.91Å; K220-E223 PolarHBondContact O-N 3.23Å; E223-F225 PolarHBondContact O-N 2.86Å
224	P	92.3	Very high	93.3	Very high	91 Å²	91	77.2 Å²	77.2	59%	0.591	43%	0.431	S	S	*	.			trans	-57.8	130.8	172	-22.7	33.2	0	0	0	111.2
225	F	95.4	Very high	93.2	Very high	23 Å²	23	77.1 Å²	77.1	10%	0.101	43%	0.434	C	S	.	.			trans	-105.4	9	-177.4	56.9	-97.9	0	0	0	113.9	H70 P103 F138 Q140 W215 K216 P218 E223	H70-F225 HydrophobicContact CB-CD2 4.28Å; H70-F225 HydrophobicContact CB-CE1 4.43Å; H70-F225 HydrophobicContact CB-CE2 3.32Å; H70-F225 HydrophobicContact CB-CZ 3.42Å; H70-F225 VanDerWaalsContact CB-CZ 3.42Å; H70-F225 AromaticContact CD2-CZ 3.66Å; H70-F225 AromaticContact CG-CE2 3.72Å; H70-F225 AromaticContact CG-CZ 3.33Å; H70-F225 AromaticContact ND1-CZ 3.87Å; P103-F225 HydrophobicContact CB-CE1 4.44Å; P103-F225 HydrophobicContact CB-CZ 4.47Å; P103-F225 HydrophobicContact CG-CE1 3.95Å; P103-F225 HydrophobicContact CG-CZ 4.18Å; F138-F225 HydrophobicContact CB-CE2 4.49Å; Q140-F225 HydrophobicContact CG-CD1 4.46Å; Q140-F225 HydrophobicContact CG-CE1 3.93Å; Q140-F225 HydrophobicContact CG-CZ 4.07Å; W215-F225 HydrophobicContact CE3-CD2 4.07Å; W215-F225 HydrophobicContact CH2-CB 3.9Å; W215-F225 HydrophobicContact CH2-CD2 4.03Å; W215-F225 HydrophobicContact CH2-CG 4.25Å; W215-F225 HydrophobicContact CZ3-CB 3.88Å; W215-F225 AromaticContact CZ3-CD2 3.31Å; W215-F225 HydrophobicContact CZ3-CD2 3.31Å; W215-F225 HydrophobicContact CZ3-CE2 4.13Å; W215-F225 AromaticContact CZ3-CG 3.94Å; W215-F225 HydrophobicContact CZ3-CG 3.94Å; K216-F225 CarbonylContact C-O 3.45Å; K216-F225 PolarHBondContact N-O 3.46Å; K216-F225 CarbonylContact O-C 3.1Å; K216-F225 WeakPolarHBondContact O-CA 3.06Å; P218-F225 HydrophobicContact CB-CB 4.26Å; P218-F225 HydrophobicContact CG-CB 4.01Å; E223-F225 PolarHBondContact O-N 2.86Å
226	V	97.1	Very high	93.2	Very high	17 Å²	17	74.1 Å²	74.1	10%	0.103	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	158.6	175.1	-62.9	0	0	0	0	111	D69 H70 F138 M213 R214	D69-V226 VanDerWaalsContact O-CG2 3.29Å; D69-V226 WeakPolarHBondContact O-CG2 3.32Å; H70-V226 HydrophobicContact CB-CG1 4.02Å; H70-V226 HydrophobicContact CB-CG2 4.02Å; F138-V226 HydrophobicContact CB-CG1 3.87Å; F138-V226 HydrophobicContact CD2-CG1 3.9Å; F138-V226 HydrophobicContact CG-CG1 4.19Å; M213-V226 HydrophobicContact CG-CB 3.93Å; M213-V226 HydrophobicContact CG-CG1 4.14Å; M213-V226 HydrophobicContact CG-CG2 4.34Å; M213-V226 HydrophobicContact SD-CB 4.21Å; M213-V226 HydrophobicContact SD-CG1 4.02Å; M213-V226 HydrophobicContact SD-CG2 4.25Å; R214-V226 CarbonylContact O-C 3.53Å; R214-V226 VanDerWaalsContact O-CA 3.22Å; R214-V226 WeakPolarHBondContact O-CA 3.45Å; R214-V226 WeakPolarHBondContact O-CB 3.45Å
227	D	97	Very high	93.2	Very high	73 Å²	73	71.4 Å²	71.4	39%	0.39	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	129.9	164.2	176.6	55.2	0	0	0	109.3	M213 R214	M213-D227 CarbonylContact C-O 3.49Å; M213-D227 WeakPolarHBondContact CA-O 3.3Å; R214-D227 HydrophobicContact CB-CB 4.32Å; R214-D227 IonicContact CZ-OD2 2.7Å; R214-D227 PolarHBondContact N-O 3.45Å; R214-D227 IonicContact NH1-OD2 3.69Å; R214-D227 PolarHBondContact NH1-OD2 3.19Å; R214-D227 PolarHBondContact O-N 3.27Å
228	W	97.4	Very high	93.5	Very high	61 Å²	61	76.3 Å²	76.3	23%	0.231	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126	-178.1	172.3	-102.3	0	0	0	110.8	I64 L66 A72 A211 M213 M230	I64-W228 HydrophobicContact CG2-CH2 3.68Å; I64-W228 HydrophobicContact CG2-CZ2 3.73Å; L66-W228 HydrophobicContact CD1-CG 4.13Å; L66-W228 HydrophobicContact CD2-CD2 3.74Å; L66-W228 HydrophobicContact CD2-CE3 4.13Å; L66-W228 HydrophobicContact CD2-CG 4Å; L66-W228 HydrophobicContact CD2-CZ2 4.22Å; L66-W228 HydrophobicContact CG-CD2 4.39Å; L66-W228 HydrophobicContact CG-CG 4.43Å; A72-W228 HydrophobicContact CB-CE3 4.32Å; A72-W228 HydrophobicContact CB-CH2 3.46Å; A72-W228 VanDerWaalsContact CB-CH2 3.46Å; A72-W228 HydrophobicContact CB-CZ2 4.34Å; A72-W228 HydrophobicContact CB-CZ3 3.48Å; A72-W228 VanDerWaalsContact CB-CZ3 3.48Å; A211-W228 HydrophobicContact CB-CH2 3.17Å; A211-W228 HydrophobicContact CB-CZ2 3.41Å; A211-W228 VanDerWaalsContact CB-CZ2 3.41Å; A211-W228 HydrophobicContact CB-CZ3 3.83Å; M213-W228 HydrophobicContact CB-CE3 3.76Å; M213-W228 HydrophobicContact CB-CZ3 4.07Å; M213-W228 HydrophobicContact CE-CD2 4.38Å; M213-W228 HydrophobicContact CE-CE3 3.62Å; M213-W228 HydrophobicContact CE-CZ3 4.07Å; M213-W228 HydrophobicContact CG-CE3 4.25Å; W228-M230 HydrophobicContact CZ2-SD 3.6Å; W228-M230 VanDerWaalsContact CZ2-SD 3.6Å
229	Q	97.5	Very high	93.7	Very high	67 Å²	67	75 Å²	75	31%	0.313	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	124.9	178.6	-172.7	179.7	-1.1	0	0	111.5	A211 V212 R214 L231	A211-Q229 CarbonylContact C-O 3.57Å; A211-Q229 VanDerWaalsContact CA-O 3.26Å; A211-Q229 WeakPolarHBondContact CA-O 3.38Å; V212-Q229 PolarHBondContact N-O 3.2Å; V212-Q229 PolarHBondContact O-N 3.26Å; R214-Q229 VanDerWaalsContact CZ-OE1 3.28Å; Q229-L231 HydrophobicContact CG-CD1 4.49Å
230	M	96.8	Very high	93.9	Very high	56 Å²	56	70.2 Å²	70.2	28%	0.276	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	121.7	158.6	-63.9	-63.5	-53	0	0	107.6	I64 E209 A211 W228	I64-M230 HydrophobicContact CB-CE 4.33Å; I64-M230 HydrophobicContact CB-SD 4.48Å; I64-M230 HydrophobicContact CD1-CE 4.38Å; I64-M230 HydrophobicContact CG2-SD 4.25Å; E209-M230 HydrophobicContact CG-CE 3.46Å; E209-M230 VanDerWaalsContact CG-CE 3.46Å; E209-M230 WeakPolarHBondContact OE1-CE 3.33Å; A211-M230 HydrophobicContact CB-CE 4.15Å; A211-M230 HydrophobicContact CB-SD 3.49Å; A211-M230 WeakPolarHBondContact CB-SD 3.38Å; W228-M230 HydrophobicContact CZ2-SD 3.6Å; W228-M230 VanDerWaalsContact CZ2-SD 3.6Å
231	L	96.2	Very high	94.2	Very high	20 Å²	20	68.6 Å²	68.6	11%	0.105	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-71.4	140.9	-179.9	-83.7	67.5	0	0	0	110.4	V190 L210 V212 Q229 D235 I236 Y239	V190-L231 HydrophobicContact CG1-CD2 4.43Å; L210-L231 HydrophobicContact CB-CB 4.46Å; L210-L231 HydrophobicContact CD2-CD1 3.79Å; L210-L231 HydrophobicContact CD2-CD2 3.82Å; L210-L231 HydrophobicContact CD2-CG 4.22Å; L210-L231 PolarHBondContact O-N 3.23Å; V212-L231 HydrophobicContact CB-CD1 4.14Å; V212-L231 HydrophobicContact CG2-CD1 3.53Å; Q229-L231 HydrophobicContact CG-CD1 4.49Å; L231-D235 HydrophobicContact CB-CB 4.44Å; L231-D235 HydrophobicContact CD2-CB 4.24Å; L231-D235 HydrophobicContact CG-CB 4.45Å; L231-I236 HydrophobicContact CB-CD1 4.34Å; L231-I236 HydrophobicContact CB-CG1 3.88Å; L231-Y239 HydrophobicContact CD2-CE2 4.15Å
232	E	94	Very high	94.6	Very high	139 Å²	139	63.4 Å²	63.4	65%	0.65	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-78.5	160.4	175.4	-62.2	-163.6	165	0	0	111.1	A234 D235 I236	E232-A234 PolarHBondContact O-N 3.07Å; E232-A234 VanDerWaalsContact O-N 3.16Å; E232-D235 PolarHBondContact O-N 3.26Å; E232-I236 WeakPolarHBondContact O-CG1 3.39Å; E232-I236 PolarHBondContact O-N 3.14Å; E232-I236 VanDerWaalsContact O-N 3.09Å
233	F	92.2	Very high	95.2	Very high	113 Å²	113	59.4 Å²	59.4	50%	0.496	29%	0.292	S	S	.	.	H	α-helix	trans	-52.1	-40.7	179.2	170.6	-98.1	0	0	0	112.6	A205 K206 D235 I236 Q237	A205-F233 HydrophobicContact CB-CD2 4.19Å; A205-F233 HydrophobicContact CB-CE2 3.92Å; K206-F233 HydrophobicContact CB-CE2 3.93Å; F233-D235 PolarHBondContact O-N 2.92Å; F233-I236 PolarHBondContact O-N 3.41Å; F233-Q237 VanDerWaalsContact O-CB 3.25Å; F233-Q237 WeakPolarHBondContact O-CB 3.49Å; F233-Q237 PolarHBondContact O-N 3.43Å
234	A	95.2	Very high	95.3	Very high	48 Å²	48	59.7 Å²	59.7	40%	0.397	29%	0.294	S	S	.	.	H	α-helix	trans	-63.4	-39.9	-179.7	0	0	0	0	0	112.4	E232 Q237 R238	E232-A234 PolarHBondContact O-N 3.07Å; E232-A234 VanDerWaalsContact O-N 3.16Å; A234-Q237 PolarHBondContact O-N 2.91Å; A234-R238 WeakPolarHBondContact O-CG 3.34Å; A234-R238 PolarHBondContact O-N 2.59Å; A234-R238 VanDerWaalsContact O-N 3.13Å
235	D	95.9	Very high	95.4	Very high	45 Å²	45	61.4 Å²	61.4	24%	0.241	29%	0.292	C	S	.	.	H	α-helix	trans	-69.8	-46.3	178.6	-62	-44	0	0	0	110.8	L231 E232 F233 Q237 R238 Y239	L231-D235 HydrophobicContact CB-CB 4.44Å; L231-D235 HydrophobicContact CD2-CB 4.24Å; L231-D235 HydrophobicContact CG-CB 4.45Å; E232-D235 PolarHBondContact O-N 3.26Å; F233-D235 PolarHBondContact O-N 2.92Å; D235-Q237 PolarHBondContact O-N 2.85Å; D235-R238 WeakPolarHBondContact O-CB 3.35Å; D235-R238 PolarHBondContact O-N 3.43Å; D235-R238 VanDerWaalsContact O-N 3.12Å; D235-R238 IonicContact OD1-NH1 2.63Å; D235-Y239 VanDerWaalsContact O-CD2 3.26Å; D235-Y239 WeakPolarHBondContact O-CD2 3.46Å; D235-Y239 PolarHBondContact O-N 2.97Å
236	I	95.6	Very high	95.3	Very high	5 Å²	5	62.7 Å²	62.7	3%	0.026	30%	0.298	C	S	.	.	H	α-helix	trans	-58.4	-41	175.4	-57.9	172.6	0	0	0	110.1	A205 M208 L210 L231 E232 F233 R238 Y239 V240	A205-I236 HydrophobicContact CB-CB 4.01Å; A205-I236 HydrophobicContact CB-CG2 3.59Å; M208-I236 HydrophobicContact CB-CG2 4.1Å; M208-I236 HydrophobicContact SD-CG2 4.17Å; L210-I236 HydrophobicContact CB-CD1 3.92Å; L210-I236 HydrophobicContact CB-CG1 4.11Å; L231-I236 HydrophobicContact CB-CD1 4.34Å; L231-I236 HydrophobicContact CB-CG1 3.88Å; E232-I236 WeakPolarHBondContact O-CG1 3.39Å; E232-I236 PolarHBondContact O-N 3.14Å; E232-I236 VanDerWaalsContact O-N 3.09Å; F233-I236 PolarHBondContact O-N 3.41Å; I236-R238 VanDerWaalsContact C-N 3.33Å; I236-R238 PolarHBondContact O-N 3.39Å; I236-Y239 PolarHBondContact O-N 3.43Å; I236-V240 HydrophobicContact CG2-CG2 4.38Å; I236-V240 WeakPolarHBondContact O-CG2 3.49Å; I236-V240 PolarHBondContact O-N 2.91Å
237	Q	95.4	Very high	95	Very high	72 Å²	72	65.8 Å²	65.8	34%	0.336	31%	0.308	S	S	.	.	H	α-helix	trans	-61.9	-38	178.5	-172.4	173.2	13.4	0	0	112.7	A205 F233 A234 D235 V240 Q241	A205-Q237 HydrophobicContact CB-CB 3.86Å; F233-Q237 VanDerWaalsContact O-CB 3.25Å; F233-Q237 WeakPolarHBondContact O-CB 3.49Å; F233-Q237 PolarHBondContact O-N 3.43Å; A234-Q237 PolarHBondContact O-N 2.91Å; D235-Q237 PolarHBondContact O-N 2.85Å; Q237-V240 PolarHBondContact O-N 3.33Å; Q237-Q241 HydrophobicContact CG-CG 4.35Å; Q237-Q241 WeakPolarHBondContact O-CB 3.2Å; Q237-Q241 VanDerWaalsContact O-CG 3.31Å; Q237-Q241 WeakPolarHBondContact O-CG 3.49Å; Q237-Q241 PolarHBondContact O-N 2.93Å
238	R	96.2	Very high	94.7	Very high	169 Å²	169	69 Å²	69	64%	0.638	32%	0.321	S	S	*	.	H	α-helix	trans	-61.9	-44.8	175.1	-70.6	168.9	178.1	171.9	-3	111.9	A234 D235 I236 Q241 A242	A234-R238 WeakPolarHBondContact O-CG 3.34Å; A234-R238 PolarHBondContact O-N 2.59Å; A234-R238 VanDerWaalsContact O-N 3.13Å; D235-R238 WeakPolarHBondContact O-CB 3.35Å; D235-R238 PolarHBondContact O-N 3.43Å; D235-R238 VanDerWaalsContact O-N 3.12Å; D235-R238 IonicContact OD1-NH1 2.63Å; I236-R238 VanDerWaalsContact C-N 3.33Å; I236-R238 PolarHBondContact O-N 3.39Å; R238-Q241 PolarHBondContact O-N 2.89Å; R238-A242 WeakPolarHBondContact O-CB 3.5Å; R238-A242 PolarHBondContact O-N 2.81Å
239	Y	96.1	Very high	94.5	Very high	30 Å²	30	70 Å²	70	12%	0.118	33%	0.328	C	S	.	.	H	α-helix	trans	-61.6	-47	175.8	-77.2	-80.6	0	0	0	111.7	Y187 V190 K191 L231 D235 I236 Q241 A242 I243	Y187-Y239 HydrophobicContact CD2-CD1 4.31Å; Y187-Y239 AromaticContact CD2-CE1 3.33Å; Y187-Y239 HydrophobicContact CD2-CE1 3.33Å; Y187-Y239 AromaticContact CD2-CZ 3.71Å; Y187-Y239 AromaticContact CE2-CD1 3.96Å; Y187-Y239 HydrophobicContact CE2-CD1 3.96Å; Y187-Y239 AromaticContact CE2-CE1 3.42Å; Y187-Y239 HydrophobicContact CE2-CE1 3.42Å; Y187-Y239 VanDerWaalsContact CE2-CE1 3.42Å; Y187-Y239 HydrophobicContact CG-CE1 4.12Å; V190-Y239 HydrophobicContact CB-CE1 3.87Å; V190-Y239 HydrophobicContact CB-CE2 4.47Å; V190-Y239 HydrophobicContact CG1-CD1 3.9Å; V190-Y239 HydrophobicContact CG1-CD2 3.89Å; V190-Y239 HydrophobicContact CG1-CE1 3.62Å; V190-Y239 HydrophobicContact CG1-CE2 3.65Å; V190-Y239 HydrophobicContact CG1-CG 4.03Å; K191-Y239 HydrophobicContact CB-CD1 4.23Å; K191-Y239 HydrophobicContact CB-CE1 4.42Å; L231-Y239 HydrophobicContact CD2-CE2 4.15Å; D235-Y239 VanDerWaalsContact O-CD2 3.26Å; D235-Y239 WeakPolarHBondContact O-CD2 3.46Å; D235-Y239 PolarHBondContact O-N 2.97Å; I236-Y239 PolarHBondContact O-N 3.43Å; Y239-Q241 PolarHBondContact O-N 3.49Å; Y239-A242 PolarHBondContact O-N 2.96Å; Y239-I243 WeakPolarHBondContact O-CB 3.38Å; Y239-I243 WeakPolarHBondContact O-CD1 3.29Å; Y239-I243 WeakPolarHBondContact O-CG1 3.4Å; Y239-I243 PolarHBondContact O-N 3.34Å
240	V	95	Very high	94.2	Very high	6 Å²	6	71.1 Å²	71.1	4%	0.036	33%	0.333	C	S	.	.	H	α-helix	trans	-59.9	-48.3	179.7	171.6	0	0	0	0	110.9	V194 M198 A205 M208 I236 Q237 A242 I243 E244	V194-V240 HydrophobicContact CG1-CG2 3.96Å; M198-V240 HydrophobicContact CE-CG1 4.11Å; M198-V240 HydrophobicContact SD-CG1 4.35Å; M198-V240 HydrophobicContact SD-CG2 4.33Å; A205-V240 HydrophobicContact CB-CG2 4.15Å; M208-V240 HydrophobicContact CE-CG2 4.21Å; M208-V240 HydrophobicContact SD-CG2 4.17Å; I236-V240 HydrophobicContact CG2-CG2 4.38Å; I236-V240 WeakPolarHBondContact O-CG2 3.49Å; I236-V240 PolarHBondContact O-N 2.91Å; Q237-V240 PolarHBondContact O-N 3.33Å; V240-A242 PolarHBondContact O-N 3.44Å; V240-I243 PolarHBondContact O-N 2.91Å; V240-E244 HydrophobicContact CG1-CG 4.34Å; V240-E244 WeakPolarHBondContact O-CG 3.36Å; V240-E244 PolarHBondContact O-N 2.93Å
241	Q	94.7	Very high	93.9	Very high	104 Å²	104	71.2 Å²	71.2	49%	0.486	34%	0.343	S	S	.	.	H	α-helix	trans	-62.6	-41.7	179.2	-74	175.2	-17.9	0	0	112.6	Q237 R238 Y239 I243 E244 K245	Q237-Q241 HydrophobicContact CG-CG 4.35Å; Q237-Q241 WeakPolarHBondContact O-CB 3.2Å; Q237-Q241 VanDerWaalsContact O-CG 3.31Å; Q237-Q241 WeakPolarHBondContact O-CG 3.49Å; Q237-Q241 PolarHBondContact O-N 2.93Å; R238-Q241 PolarHBondContact O-N 2.89Å; Y239-Q241 PolarHBondContact O-N 3.49Å; Q241-I243 VanDerWaalsContact C-N 3.32Å; Q241-I243 PolarHBondContact O-N 3.48Å; Q241-E244 PolarHBondContact O-N 3.17Å; Q241-K245 WeakPolarHBondContact O-CB 3.24Å; Q241-K245 PolarHBondContact O-N 2.86Å
242	A	94.6	Very high	93.7	Very high	29 Å²	29	75.7 Å²	75.7	24%	0.24	36%	0.363	C	S	.	.	H	α-helix	trans	-62.1	-41.6	175.8	0	0	0	0	0	111.6	R238 Y239 V240 E246	R238-A242 WeakPolarHBondContact O-CB 3.5Å; R238-A242 PolarHBondContact O-N 2.81Å; Y239-A242 PolarHBondContact O-N 2.96Å; V240-A242 PolarHBondContact O-N 3.44Å; A242-E246 WeakPolarHBondContact O-CG 3.49Å; A242-E246 PolarHBondContact O-N 2.95Å; A242-E246 VanDerWaalsContact O-N 3.08Å
243	I	94.4	Very high	93.5	Very high	1 Å²	1	74.8 Å²	74.8	1%	0.005	36%	0.357	C	S	.	.	H	α-helix	trans	-67.3	-43.1	177.9	-70.3	163.3	0	0	0	111.7	K191 V194 K195 M198 Y239 V240 Q241 E246 R247	K191-I243 HydrophobicContact CG-CD1 4.11Å; K191-I243 HydrophobicContact CG-CG1 4.01Å; V194-I243 HydrophobicContact CB-CD1 3.7Å; V194-I243 HydrophobicContact CG1-CD1 3.45Å; V194-I243 VanDerWaalsContact CG1-CD1 3.45Å; K195-I243 HydrophobicContact CD-CG1 4.47Å; K195-I243 HydrophobicContact CD-CG2 4.44Å; K195-I243 HydrophobicContact CG-CB 4.4Å; K195-I243 HydrophobicContact CG-CD1 3.69Å; K195-I243 HydrophobicContact CG-CG1 3.79Å; K195-I243 HydrophobicContact CG-CG2 3.7Å; M198-I243 HydrophobicContact CE-CG2 4.15Å; M198-I243 HydrophobicContact SD-CB 4.26Å; M198-I243 HydrophobicContact SD-CD1 4.29Å; M198-I243 HydrophobicContact SD-CG2 3.76Å; Y239-I243 WeakPolarHBondContact O-CB 3.38Å; Y239-I243 WeakPolarHBondContact O-CD1 3.29Å; Y239-I243 WeakPolarHBondContact O-CG1 3.4Å; Y239-I243 PolarHBondContact O-N 3.34Å; V240-I243 PolarHBondContact O-N 2.91Å; Q241-I243 VanDerWaalsContact C-N 3.32Å; Q241-I243 PolarHBondContact O-N 3.48Å; I243-E246 PolarHBondContact O-N 3.35Å; I243-R247 WeakPolarHBondContact O-CG 3.32Å; I243-R247 PolarHBondContact O-N 3.48Å
244	E	93.2	Very high	93.4	Very high	84 Å²	84	75.6 Å²	75.6	39%	0.393	36%	0.361	S	S	.	.	H	α-helix	trans	-61.2	-46.2	177.8	-73.3	175	160.1	0	0	110.7	M198 V240 Q241 E246 R247 E248	M198-E244 HydrophobicContact CE-CG 3.81Å; V240-E244 HydrophobicContact CG1-CG 4.34Å; V240-E244 WeakPolarHBondContact O-CG 3.36Å; V240-E244 PolarHBondContact O-N 2.93Å; Q241-E244 PolarHBondContact O-N 3.17Å; E244-E246 PolarHBondContact O-N 3.32Å; E244-R247 WeakPolarHBondContact O-CB 3.4Å; E244-R247 PolarHBondContact O-N 3.36Å; E244-R247 VanDerWaalsContact O-N 3.15Å; E244-E248 WeakPolarHBondContact O-CG 3.48Å; E244-E248 PolarHBondContact O-N 3.36Å
245	K	94.2	Very high	93.2	Very high	128 Å²	128	81.1 Å²	81.1	56%	0.557	37%	0.371	S	S	*	.	H	α-helix	trans	-58.9	-44.6	175.8	-172.7	-179.7	177.3	-172.9	0	112.4	Q241 R247 E248 E249	Q241-K245 WeakPolarHBondContact O-CB 3.24Å; Q241-K245 PolarHBondContact O-N 2.86Å; K245-R247 VanDerWaalsContact C-N 3.32Å; K245-R247 PolarHBondContact O-N 2.83Å; K245-E248 PolarHBondContact O-N 3.44Å; K245-E249 WeakPolarHBondContact CE-OE1 3.21Å; K245-E249 WeakPolarHBondContact O-CG 3.3Å; K245-E249 PolarHBondContact O-N 3.26Å
246	E	93	Very high	92.9	Very high	50 Å²	50	84 Å²	84	23%	0.234	38%	0.383	C	S	.	.	H	α-helix	trans	-60.6	-41.2	175.7	-77.1	174.2	-167.2	0	0	112.4	K191 K195 A242 I243 E244 E249 E250	K191-E246 VanDerWaalsContact CE-OE1 3.31Å; K191-E246 WeakPolarHBondContact CE-OE1 3.11Å; K191-E246 WeakPolarHBondContact CE-OE2 3.06Å; K191-E246 IonicContact NZ-OE1 2.75Å; K191-E246 PolarHBondContact NZ-OE1 3.17Å; K191-E246 IonicContact NZ-OE2 3.48Å; K191-E246 PolarHBondContact NZ-OE2 2.97Å; K195-E246 WeakPolarHBondContact CE-OE2 3.43Å; K195-E246 IonicContact NZ-OE2 3.79Å; K195-E246 PolarHBondContact NZ-OE2 2.85Å; A242-E246 WeakPolarHBondContact O-CG 3.49Å; A242-E246 PolarHBondContact O-N 2.95Å; A242-E246 VanDerWaalsContact O-N 3.08Å; I243-E246 PolarHBondContact O-N 3.35Å; E244-E246 PolarHBondContact O-N 3.32Å; E246-E249 PolarHBondContact O-N 3.45Å; E246-E250 WeakPolarHBondContact O-CB 3.45Å; E246-E250 WeakPolarHBondContact O-CG 3.43Å; E246-E250 PolarHBondContact O-N 3.35Å
247	R	90.4	Very high	92.5	Very high	82 Å²	82	91.1 Å²	91.1	31%	0.309	41%	0.414	S	S	.	.	H	α-helix	trans	-64.8	-40.2	178.1	-73.5	176.3	-179.2	-153.7	-4.9	111.8	K195 E199 I243 E244 K245 A251	K195-R247 PolarHBondContact O-NH2 2.68Å; E199-R247 IonicContact OE1-CZ 2.57Å; E199-R247 VanDerWaalsContact OE1-CZ 3.32Å; E199-R247 IonicContact OE1-NH1 3.32Å; E199-R247 PolarHBondContact OE1-NH1 3.01Å; E199-R247 IonicContact OE1-NH2 2.79Å; E199-R247 PolarHBondContact OE1-NH2 3.49Å; I243-R247 WeakPolarHBondContact O-CG 3.32Å; I243-R247 PolarHBondContact O-N 3.48Å; E244-R247 WeakPolarHBondContact O-CB 3.4Å; E244-R247 PolarHBondContact O-N 3.36Å; E244-R247 VanDerWaalsContact O-N 3.15Å; K245-R247 VanDerWaalsContact C-N 3.32Å; K245-R247 PolarHBondContact O-N 2.83Å; R247-A251 VanDerWaalsContact O-CB 3.3Å; R247-A251 WeakPolarHBondContact O-CB 3.3Å; R247-A251 PolarHBondContact O-N 3.1Å
248	E	91.5	Very high	92.2	Very high	140 Å²	140	95.2 Å²	95.2	65%	0.654	43%	0.431	S	S	*	.	H	α-helix	trans	-63.6	-48.1	176.1	-71.6	176.2	176.7	0	0	111.5	E244 K245 E250 A251 E252	E244-E248 WeakPolarHBondContact O-CG 3.48Å; E244-E248 PolarHBondContact O-N 3.36Å; K245-E248 PolarHBondContact O-N 3.44Å; E248-E250 PolarHBondContact O-N 3.35Å; E248-A251 PolarHBondContact O-N 2.83Å; E248-E252 PolarHBondContact O-N 3.3Å
249	E	93.4	Very high	91.8	Very high	81 Å²	81	92.2 Å²	92.2	38%	0.379	42%	0.424	S	S	.	.	H	α-helix	trans	-62.7	-39.9	177.6	-70.4	177.3	-168.6	0	0	112.3	K245 E246 K253	K245-E249 WeakPolarHBondContact CE-OE1 3.21Å; K245-E249 WeakPolarHBondContact O-CG 3.3Å; K245-E249 PolarHBondContact O-N 3.26Å; E246-E249 PolarHBondContact O-N 3.45Å; E249-K253 WeakPolarHBondContact O-CB 3.02Å; E249-K253 VanDerWaalsContact O-CG 3.26Å; E249-K253 WeakPolarHBondContact O-CG 3.41Å; E249-K253 PolarHBondContact O-N 3.1Å
250	E	90.7	Very high	91.3	Very high	92 Å²	92	93.6 Å²	93.6	43%	0.43	44%	0.442	S	S	.	.	H	α-helix	trans	-65.9	-39.3	174.5	-77.5	-179	-160.7	0	0	112.4	E246 E248 K254	E246-E250 WeakPolarHBondContact O-CB 3.45Å; E246-E250 WeakPolarHBondContact O-CG 3.43Å; E246-E250 PolarHBondContact O-N 3.35Å; E248-E250 PolarHBondContact O-N 3.35Å; E250-K254 WeakPolarHBondContact O-CB 3.29Å; E250-K254 VanDerWaalsContact O-CG 3.26Å; E250-K254 WeakPolarHBondContact O-CG 3.32Å; E250-K254 PolarHBondContact O-N 2.86Å
251	A	90.2	Very high	90.8	Very high	58 Å²	58	96.5 Å²	96.5	48%	0.479	47%	0.466	S	S	.	.	H	α-helix	trans	-66.5	-42.1	176.9	0	0	0	0	0	111.3	R247 E248 K254 R255	R247-A251 VanDerWaalsContact O-CB 3.3Å; R247-A251 WeakPolarHBondContact O-CB 3.3Å; R247-A251 PolarHBondContact O-N 3.1Å; E248-A251 PolarHBondContact O-N 2.83Å; A251-K254 PolarHBondContact O-N 3.24Å; A251-R255 WeakPolarHBondContact O-CB 3.49Å; A251-R255 PolarHBondContact O-N 3.4Å
252	E	91.6	Very high	90.3	Very high	113 Å²	113	95.6 Å²	95.6	53%	0.528	48%	0.476	S	S	.	.	H	α-helix	trans	-63.3	-46.9	176	-168.9	-179.9	177.6	0	0	111.3	E248 K254 R255 Q256	E248-E252 PolarHBondContact O-N 3.3Å; E252-K254 VanDerWaalsContact C-N 3.31Å; E252-K254 PolarHBondContact O-N 3.4Å; E252-R255 WeakPolarHBondContact O-CB 3.49Å; E252-R255 PolarHBondContact O-N 3.28Å; E252-R255 VanDerWaalsContact O-N 3.09Å; E252-Q256 WeakPolarHBondContact O-CG 3.39Å; E252-Q256 PolarHBondContact O-N 2.68Å; E252-Q256 PolarHBondContact OE1-NE2 3.38Å
253	K	90.7	Very high	89.8	Confident	120 Å²	120	98.4 Å²	98.4	52%	0.522	50%	0.5	S	S	.	.	H	α-helix	trans	-59.3	-40.8	174.9	-73.9	168.5	-175.1	166.3	0	112.2	E249 R255 K257	E249-K253 WeakPolarHBondContact O-CB 3.02Å; E249-K253 VanDerWaalsContact O-CG 3.26Å; E249-K253 WeakPolarHBondContact O-CG 3.41Å; E249-K253 PolarHBondContact O-N 3.1Å; K253-R255 VanDerWaalsContact C-N 3.34Å; K253-K257 WeakPolarHBondContact O-CB 3.21Å; K253-K257 VanDerWaalsContact O-CG 3.29Å; K253-K257 WeakPolarHBondContact O-CG 3.35Å; K253-K257 PolarHBondContact O-N 2.97Å
254	K	90.1	Very high	88.8	Confident	130 Å²	130	108.3 Å²	108.3	57%	0.565	55%	0.551	S	S	*	*	H	α-helix	trans	-66.1	-37.2	175.7	-76.6	170.1	-176.3	165.3	0	111.7	E250 A251 E252 K258	E250-K254 WeakPolarHBondContact O-CB 3.29Å; E250-K254 VanDerWaalsContact O-CG 3.26Å; E250-K254 WeakPolarHBondContact O-CG 3.32Å; E250-K254 PolarHBondContact O-N 2.86Å; A251-K254 PolarHBondContact O-N 3.24Å; E252-K254 VanDerWaalsContact C-N 3.31Å; E252-K254 PolarHBondContact O-N 3.4Å; K254-K258 WeakPolarHBondContact O-CG 3.36Å; K254-K258 PolarHBondContact O-N 3.49Å; K254-K258 VanDerWaalsContact O-N 3.14Å
255	R	90.1	Very high	88.6	Confident	165 Å²	165	109.5 Å²	109.5	62%	0.623	56%	0.559	S	S	*	*	H	α-helix	trans	-67.1	-49.5	176.6	-177.1	178.9	168.8	-178.4	-2.4	111.5	A251 E252 K253 K257 K258 E259	A251-R255 WeakPolarHBondContact O-CB 3.49Å; A251-R255 PolarHBondContact O-N 3.4Å; E252-R255 WeakPolarHBondContact O-CB 3.49Å; E252-R255 PolarHBondContact O-N 3.28Å; E252-R255 VanDerWaalsContact O-N 3.09Å; K253-R255 VanDerWaalsContact C-N 3.34Å; R255-K257 VanDerWaalsContact C-N 3.31Å; R255-K257 PolarHBondContact O-N 3.27Å; R255-K258 WeakPolarHBondContact O-CB 3.27Å; R255-K258 PolarHBondContact O-N 2.87Å; R255-K258 VanDerWaalsContact O-N 3.08Å; R255-E259 WeakPolarHBondContact CG-OE1 3.12Å; R255-E259 IonicContact CZ-OE1 3.58Å; R255-E259 IonicContact NE-OE1 2.84Å; R255-E259 PolarHBondContact NE-OE1 3.09Å; R255-E259 IonicContact NH2-OE1 3.43Å; R255-E259 PolarHBondContact NH2-OE1 3.29Å; R255-E259 WeakPolarHBondContact O-CG 3.41Å; R255-E259 PolarHBondContact O-N 3.17Å
256	Q	89.7	Confident	88.3	Confident	104 Å²	104	108.5 Å²	108.5	49%	0.486	56%	0.559	S	S	.	*	H	α-helix	trans	-58.9	-41.4	176.9	-69.5	174.5	2	0	0	111.9	E252 K258 E259 A260	E252-Q256 WeakPolarHBondContact O-CG 3.39Å; E252-Q256 PolarHBondContact O-N 2.68Å; E252-Q256 PolarHBondContact OE1-NE2 3.38Å; Q256-K258 VanDerWaalsContact C-N 3.35Å; Q256-K258 PolarHBondContact O-N 2.88Å; Q256-E259 PolarHBondContact O-N 3.4Å; Q256-A260 WeakPolarHBondContact O-CB 3.13Å; Q256-A260 PolarHBondContact O-N 3.15Å
257	K	88.1	Confident	88	Confident	155 Å²	155	111.8 Å²	111.8	67%	0.674	58%	0.578	S	S	*	*	H	α-helix	trans	-62.6	-38.5	174.7	-76.3	179.3	179.8	-173.3	0	113	K253 R255 A261	K253-K257 WeakPolarHBondContact O-CB 3.21Å; K253-K257 VanDerWaalsContact O-CG 3.29Å; K253-K257 WeakPolarHBondContact O-CG 3.35Å; K253-K257 PolarHBondContact O-N 2.97Å; R255-K257 VanDerWaalsContact C-N 3.31Å; R255-K257 PolarHBondContact O-N 3.27Å; K257-A261 WeakPolarHBondContact O-CB 3.35Å; K257-A261 PolarHBondContact O-N 2.95Å
258	K	87.6	Confident	87.9	Confident	159 Å²	159	113.5 Å²	113.5	69%	0.691	59%	0.593	S	S	*	*	H	α-helix	trans	-69.5	-41.9	176.4	-75.5	179.1	177.6	-172.7	0	112	K254 R255 Q256 A261 A262	K254-K258 WeakPolarHBondContact O-CG 3.36Å; K254-K258 PolarHBondContact O-N 3.49Å; K254-K258 VanDerWaalsContact O-N 3.14Å; R255-K258 WeakPolarHBondContact O-CB 3.27Å; R255-K258 PolarHBondContact O-N 2.87Å; R255-K258 VanDerWaalsContact O-N 3.08Å; Q256-K258 VanDerWaalsContact C-N 3.35Å; Q256-K258 PolarHBondContact O-N 2.88Å; K258-A261 PolarHBondContact O-N 2.85Å; K258-A262 WeakPolarHBondContact O-CB 3.33Å; K258-A262 PolarHBondContact O-N 3.18Å
259	E	89	Confident	87.7	Confident	105 Å²	105	111.9 Å²	111.9	49%	0.491	59%	0.59	S	S	.	*	H	α-helix	trans	-64.3	-42.2	176.8	-71.6	172.5	-178	0	0	111	R255 Q256 A262 A263	R255-E259 WeakPolarHBondContact CG-OE1 3.12Å; R255-E259 IonicContact CZ-OE1 3.58Å; R255-E259 IonicContact NE-OE1 2.84Å; R255-E259 PolarHBondContact NE-OE1 3.09Å; R255-E259 IonicContact NH2-OE1 3.43Å; R255-E259 PolarHBondContact NH2-OE1 3.29Å; R255-E259 WeakPolarHBondContact O-CG 3.41Å; R255-E259 PolarHBondContact O-N 3.17Å; Q256-E259 PolarHBondContact O-N 3.4Å; E259-A262 PolarHBondContact O-N 3.35Å; E259-A263 PolarHBondContact O-N 3Å
260	A	85.8	Confident	87.3	Confident	60 Å²	60	113.9 Å²	113.9	50%	0.496	60%	0.604	S	S	.	*	H	α-helix	trans	-64.9	-39.4	174.3	0	0	0	0	0	113	Q256 A262 A263	Q256-A260 WeakPolarHBondContact O-CB 3.13Å; Q256-A260 PolarHBondContact O-N 3.15Å; A260-A262 VanDerWaalsContact C-N 3.32Å; A260-A262 PolarHBondContact O-N 2.84Å; A260-A263 PolarHBondContact O-N 2.94Å
261	A	84.5	Confident	87	Confident	66 Å²	66	115.5 Å²	115.5	55%	0.545	62%	0.616	S	S	.	*	H	α-helix	trans	-70.5	-26.4	177.2	0	0	0	0	0	113.4	K257 K258	K257-A261 WeakPolarHBondContact O-CB 3.35Å; K257-A261 PolarHBondContact O-N 2.95Å; K258-A261 PolarHBondContact O-N 2.85Å
262	A	84.3	Confident	86.8	Confident	85 Å²	85	119.9 Å²	119.9	70%	0.702	63%	0.627	S	S	*	*	H	α-helix	trans	-82.8	-13.6	176.7	0	0	0	0	0	113.5	K258 E259 A260	K258-A262 WeakPolarHBondContact O-CB 3.33Å; K258-A262 PolarHBondContact O-N 3.18Å; E259-A262 PolarHBondContact O-N 3.35Å; A260-A262 VanDerWaalsContact C-N 3.32Å; A260-A262 PolarHBondContact O-N 2.84Å
263	A	82.9	Confident	86.4	Confident	88 Å²	88	120.5 Å²	120.5	73%	0.727	64%	0.635	S	S	*	*			trans	-91	-3.8	178.3	0	0	0	0	0	113.8	E259 A260	E259-A263 PolarHBondContact O-N 3Å; A260-A263 PolarHBondContact O-N 2.94Å
264	L	73.9	Confident	86	Confident	209 Å²	209	120.5 Å²	120.5	100%	1.094	65%	0.645	S	S	*	*			trans	-98.3	0	173.7	-69.2	171.6	0	0	0	110.4

Retrieved 264 of 264 residues in 52.7 ms (Link to these results)

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